Search results for: '818-81-5'

: 2-Methyloctan-1-ol
Cas Number: 818-81-5

Formula: C₉H₂₀O

Molecular weight: 144.26

Synonyms: 2-Methyloctan-1-ol|818-81-5|2-Methyloctanol|2-Methyl-1-octanol|1-Octanol, 2-methyl-|4FT7336DZ7|EINEC...

SMILES: CCCCCCC(C)CO

InChIKey: IGVGCQGTEINVOH-UHFFFAOYSA-N

InChI: InChI=1S/C9H20O/c1-3-4-5-6-7-9(2)8-10/h9-10H,3-8H2,1-2H3

Product No.
Description
Grade & Purity (?)

M195173
2-Methyloctan-1-ol
- ≥95%
| Pricing Close

: LGX 818, Serine/threonine-protein kinase B-raf inhibitor
Cas Number: 1269440-17-6

Formula: C₂₂H₂₇ClFN₇O₄S

Molecular weight: 540.01

Synonyms: LGX-818(Encorafenib) | ENCORAFENIB [WHO-DD] | Encorafenib (LGX818) | HY-15605 | LGX 818 | EN300-2469...

SMILES: CC(C)N1C=C(C(=N1)C2=C(C(=CC(=C2)Cl)NS(=O)(=O)C)F)C3=NC(=NC=C3)NCC(C)NC(=O)OC

InChIKey: CMJCXYNUCSMDBY-ZDUSSCGKSA-N

InChI: InChI=1S/C22H27ClFN7O4S/c1-12(2)31-11-16(17-6-7-25-21(28-17)26-10-13(3)27-22(32)35-4)20(29-31)15-8-14(23)9-18(19(15)24)30-36(5,33)34/h6-9,11-13,30H,10H2,1-5H3,(H,27,32)(H,25,26,28)/t13-/m0/s1

Product No.
Description
Grade & Purity (?)

L353945
LGX 818, Serine/threonine-protein kinase B-raf inhibitor
| Pricing Close

: 3,4,4',5-Tetrachlorobiphenyl
1 Citations

Cas Number: 70362-50-4

Formula: C₁₂H₆Cl₄

Molecular weight: 291.99

Synonyms: 3,4,4',5-TETRACHLOROBIPHENYL|70362-50-4|PCB 81|3,4,4',5-Tetrachloro-1,1'-biphenyl|UNII-7R8ZU2864J|1,...

SMILES: C1=CC(=CC=C1C2=CC(=C(C(=C2)Cl)Cl)Cl)Cl

InChIKey: BHWVLZJTVIYLIV-UHFFFAOYSA-N

InChI: InChI=1S/C12H6Cl4/c13-9-3-1-7(2-4-9)8-5-10(14)12(16)11(15)6-8/h1-6H

Product No.
Description
Grade & Purity (?)

T128828
3,4,4',5-Tetrachlorobiphenyl
- 100 ug/mL in Isooctane
| Pricing Close

: 4-Amino-5-methylpyridin-2-ol
Cas Number: 95306-64-2

Formula: C₆H₈N₂O

Molecular weight: 124.14

Synonyms: 4-Amino-5-methylpyridin-2-ol|95306-64-2|4-Amino-2-hydroxy-5-methylpyridine|4-amino-5-methylpyridin-2...

SMILES: CC1=CNC(=O)C=C1N

InChIKey: SSQZBQXJYGNUSC-UHFFFAOYSA-N

InChI: InChI=1S/C6H8N2O/c1-4-3-8-6(9)2-5(4)7/h2-3H,1H3,(H3,7,8,9)

Product No.
Description
Grade & Purity (?)

A196047
4-Amino-5-methylpyridin-2-ol
- ≥98%
| Pricing Close

: 4-Ethylphenyl Acetate
Cas Number: 3245-23-6

Formula: C₁₀H₁₂O₂

Molecular weight: 164.2

Synonyms: MFCD00026970 | Phenol, 4-ethyl-, 1-acetate | 4-Ethylphenyl acetate | EINECS 221-818-6 | InChI=1/C10H...

SMILES: CCC1=CC=C(C=C1)OC(=O)C

InChIKey: ANMYMLIUCWWISO-UHFFFAOYSA-N

InChI: InChI=1S/C10H12O2/c1-3-9-4-6-10(7-5-9)12-8(2)11/h4-7H,3H2,1-2H3

Product No.
Description
Grade & Purity (?)

E156506
4-Ethylphenyl Acetate
- ≥96%(GC)
| Pricing Close

: 5-Methyl-4-phenyl-2H-pyrazol-3-amine
Cas Number: 60419-81-0

Formula: C₁₀H₁₁N₃

Molecular weight: 173.2

Synonyms: 3-Methyl-4-phenyl-1H-pyrazol-5-amine|60419-81-0|31924-81-9|5-Methyl-4-phenyl-2H-pyrazol-3-ylamine|5-...

SMILES: CC1=C(C(=NN1)N)C2=CC=CC=C2

InChIKey: UMDNRKCXSUJMCY-UHFFFAOYSA-N

InChI: InChI=1S/C10H11N3/c1-7-9(10(11)13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H3,11,12,13)

Product No.
Description
Grade & Purity (?)

M185511
5-Methyl-4-phenyl-2H-pyrazol-3-amine
- ≥97%
| Pricing Close

: benzyl N-(2-bicyclo[2.2.2]oct-5-enyl)carbamate
Cas Number: 2289900-81-6

Formula: C₁₆H₁₉NO₂

Molecular weight: 257.33

Synonyms: benzyl N-(2-bicyclo[2.2.2]oct-5-enyl)carbamate | 2289900-81-6 | F89214

SMILES: C1CC2C=CC1CC2NC(=O)OCC3=CC=CC=C3

InChIKey: VSMNBEDECAGXBJ-UHFFFAOYSA-N

InChI: InChI=1S/C16H19NO2/c18-16(19-11-13-4-2-1-3-5-13)17-15-10-12-6-8-14(15)9-7-12/h1-6,8,12,14-15H,7,9-11H2,(H,17,18)

Product No.
Description
Grade & Purity (?)

B632519
benzyl N-(2-bicyclo[2.2.2]oct-5-enyl)carbamate
- ≥97%
| Pricing Close

: (3S,5S)-5-methylpiperidine-3-carboxylic acid
Cas Number: 1932141-81-5

Formula: C₇H₁₃NO₂

Molecular weight: 143.18

Synonyms: (3S,5S)-5-methylpiperidine-3-carboxylic acid | 1932141-81-5 | 110287-72-4 | AKOS006381367 | AT31365 ...

SMILES: CC1CC(CNC1)C(=O)O

InChIKey: CBDSIHCOUDRMMA-WDSKDSINSA-N

InChI: InChI=1S/C7H13NO2/c1-5-2-6(7(9)10)4-8-3-5/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6-/m0/s1

Product No.
Description
Grade & Purity (?)

M631080
(3S,5S)-5-methylpiperidine-3-carboxylic acid
- ≥97%
| Pricing Close

: 2-bromo-5-chloropyridine-3-carbonitrile
Cas Number: 1256823-81-0

Formula: C₆H₂BrClN₂

Molecular weight: 217.45

Synonyms: BS-42833 | SY270371 | PB40112 | 2-bromo-5-chloropyridine-3-carbonitrile | P19613 | 2-Bromo-5-chloron...

SMILES: C1=C(C=NC(=C1C#N)Br)Cl

InChIKey: OFSKXYROHCSOBC-UHFFFAOYSA-N

InChI: InChI=1S/C6H2BrClN2/c7-6-4(2-9)1-5(8)3-10-6/h1,3H

Product No.
Description
Grade & Purity (?)

B627847
2-bromo-5-chloropyridine-3-carbonitrile
- ≥97%
| Pricing Close

: N-(5-amino-2,4-diiodo-phenyl)acetamide
Cas Number: 123765-81-1

Formula: C₈H₈N₂OI₂

Molecular weight: 401.97

Synonyms: N-(5-amino-2,4-diiodo-phenyl)acetamide | 123765-81-1 | N-(5-Amino-2,4-diiodophenyl)acetamide | starb...

SMILES: CC(=O)NC1=C(C=C(C(=C1)N)I)I

InChIKey: NOGHJBRQBPKDFH-UHFFFAOYSA-N

InChI: InChI=1S/C8H8I2N2O/c1-4(13)12-8-3-7(11)5(9)2-6(8)10/h2-3H,11H2,1H3,(H,12,13)

Product No.
Description
Grade & Purity (?)

N627635
N-(5-amino-2,4-diiodo-phenyl)acetamide
- ≥97%
| Pricing Close

: Methyl 5-(methylsulfonyl)pyridine-2-carboxylate
Cas Number: 1201326-81-9

Formula: C₈H₉NO₄S

Molecular weight: 215.2

Synonyms: 1201326-81-9|Methyl 5-(methylsulfonyl)picolinate|METHYL 5-(METHYLSULFONYL)PYRIDINE-2-CARBOXYLATE|met...

SMILES: COC(=O)C1=NC=C(C=C1)S(=O)(=O)C

InChIKey: OANIRYJPNCZNHW-UHFFFAOYSA-N

InChI: InChI=1S/C8H9NO4S/c1-13-8(10)7-4-3-6(5-9-7)14(2,11)12/h3-5H,1-2H3

Product No.
Description
Grade & Purity (?)

M180076
Methyl 5-(methylsulfonyl)pyridine-2-carboxylate
- ≥95%
| Pricing Close

: 1-Quinolin-5-yl-methylamine, HCl
8 Citations

Cas Number: 1187931-81-2

Formula: C₁₀H₁₀N₂.ClH

Molecular weight: 194.7

Synonyms: 1-Quinolin-5-yl-methylamine hydrochloride|1187931-81-2|quinolin-5-ylmethanamine hydrochloride|C-Quin...

SMILES: C1=CC(=C2C=CC=NC2=C1)CN.Cl

InChIKey: LSVBCYBGVYQEJX-UHFFFAOYSA-N

InChI: InChI=1S/C10H10N2.ClH/c11-7-8-3-1-5-10-9(8)4-2-6-12-10;/h1-6H,7,11H2;1H

Product No.
Description
Grade & Purity (?)

Q179975
1-Quinolin-5-yl-methylamine, HCl
- ≥95%
| Pricing Close

: 2,4-Dichloro-5-ethoxyphenylboronic acid
Cas Number: 915200-81-6

Formula: C₈H₉BCl₂O₃

Molecular weight: 234.9

Synonyms: 915200-81-6|(2,4-Dichloro-5-ethoxyphenyl)boronic acid|2,4-DICHLORO-5-ETHOXYPHENYLBORONIC ACID|(2,4-D...

SMILES: B(C1=CC(=C(C=C1Cl)Cl)OCC)(O)O

InChIKey: VVHOCDCNPFIXLE-UHFFFAOYSA-N

InChI: InChI=1S/C8H9BCl2O3/c1-2-14-8-3-5(9(12)13)6(10)4-7(8)11/h3-4,12-13H,2H2,1H3

Product No.
Description
Grade & Purity (?)

D188224
2,4-Dichloro-5-ethoxyphenylboronic acid
- ≥98%
| Pricing Close

: 4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine
Cas Number: 1261365-81-4

Formula: C₈H₇F₃INO₂

Molecular weight: 333

Synonyms: 4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine|1261365-81-4|DTXSID401223722|MFCD18374095|AKOS01585...

SMILES: COC1=C(C(=CN=C1OC)C(F)(F)F)I

InChIKey: ZFISGSRXCHTAGD-UHFFFAOYSA-N

InChI: InChI=1S/C8H7F3INO2/c1-14-6-5(12)4(8(9,10)11)3-13-7(6)15-2/h3H,1-2H3

Product No.
Description
Grade & Purity (?)

I180798
4-Iodo-2,3-dimethoxy-5-(trifluoromethyl)pyridine
- ≥95%
| Pricing Close

: 5-ethyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
Cas Number: 856437-81-5

Formula: C₁₀H₁₄N₂O₂

Molecular weight: 194.23

Synonyms: 5-Ethyl-4,5,6,7-tetrahydro-2H-indazole-3-carboxylic acid | 856437-81-5 | 5-ethyl-4,5,6,7-tetrahydro-...

SMILES: CCC1CCC2=C(C1)C(=NN2)C(=O)O

InChIKey: PPQQUGJFBVPEOE-UHFFFAOYSA-N

InChI: InChI=1S/C10H14N2O2/c1-2-6-3-4-8-7(5-6)9(10(13)14)12-11-8/h6H,2-5H2,1H3,(H,11,12)(H,13,14)

Product No.
Description
Grade & Purity (?)

E636076
5-ethyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
- ≥97%
| Pricing Close

: 2-(5-Bromopyridin-3-yl)-5-propyl-1,3,4-oxadiazole
Cas Number: 1187385-81-4

Formula: C₁₀H₁₀BrN₃O

Molecular weight: 268.1

Synonyms: 2-(5-BROMOPYRIDIN-3-YL)-5-PROPYL-1,3,4-OXADIAZOLE|1187385-81-4|3-Bromo-5-(5-propyl-1,3,4-oxadiazol-2...

SMILES: CCCC1=NN=C(O1)C2=CC(=CN=C2)Br

InChIKey: NXCRQOJMGOGZLB-UHFFFAOYSA-N

InChI: InChI=1S/C10H10BrN3O/c1-2-3-9-13-14-10(15-9)7-4-8(11)6-12-5-7/h4-6H,2-3H2,1H3

Product No.
Description
Grade & Purity (?)

B179918
2-(5-Bromopyridin-3-yl)-5-propyl-1,3,4-oxadiazole
- ≥98%
| Pricing Close

: 5-Chloropyrazine-2,3-diamine
Cas Number: 1259479-81-6

Formula: C₄H₅ClN₄

Molecular weight: 144.56

Synonyms: 5-Chloropyrazine-2,3-diamine|1259479-81-6|2,3-DIAMINO-5-CHLOROPYRAZINE|2,3-Pyrazinediamine,5-chloro-...

SMILES: C1=C(N=C(C(=N1)N)N)Cl

InChIKey: GASZPECEAGTOIN-UHFFFAOYSA-N

InChI: InChI=1S/C4H5ClN4/c5-2-1-8-3(6)4(7)9-2/h1H,(H2,6,8)(H2,7,9)

Product No.
Description
Grade & Purity (?)

C190357
5-Chloropyrazine-2,3-diamine
- ≥98%
| Pricing Close

: 1-Acetoxy-5-bromo-1,2-benziodoxol-3(1H)-one
Cas Number: 1580548-81-7

Formula: C₉H₆BrIO₄

Molecular weight: 384.95

Synonyms: (5-bromo-3-oxo-1lambda3,2-benziodoxol-1-yl) acetate | MFCD28100817 | 1580548-81-7 | T70347 | 1-Aceto...

SMILES: CC(=O)OI1C2=C(C=C(C=C2)Br)C(=O)O1

InChIKey: QPZPQFBDNWCSGA-UHFFFAOYSA-N

InChI: InChI=1S/C9H6BrIO4/c1-5(12)14-11-8-3-2-6(10)4-7(8)9(13)15-11/h2-4H,1H3

Product No.
Description
Grade & Purity (?)

A151489
1-Acetoxy-5-bromo-1,2-benziodoxol-3(1H)-one
- ≥97%
| Pricing Close

: (3R,4R)-3-fluoro-4-methoxypiperidine hydrochloride
Cas Number: 2306248-81-5

Synonyms: (3R,4R)-3-Fluoro-4-methoxypiperidine hydrochloride | 2306248-81-5 | trans-3-Fluoro-4-methoxypiperidi...

SMILES: COC1CCNCC1F.Cl

InChIKey: RXBHOPYLIYPIMX-KGZKBUQUSA-N

InChI: InChI=1S/C6H12FNO.ClH/c1-9-6-2-3-8-4-5(6)7;/h5-6,8H,2-4H2,1H3;1H/t5-,6-;/m1./s1

Product No.
Description
Grade & Purity (?)

F632595
(3R,4R)-3-fluoro-4-methoxypiperidine hydrochloride
- ≥97%
| Pricing Close

: 4-Oxocyclohexanecarbaldehyde
Cas Number: 96184-81-5

Formula: C₇H₁₀O₂

Molecular weight: 126.15

Synonyms: 4-oxocyclohexanecarbaldehyde|96184-81-5|Cyclohexanone-4-carboxaldehyde|4-oxocyclohexane-1-carbaldehy...

SMILES: C1CC(=O)CCC1C=O

InChIKey: SFNKUFOBKQJUEB-UHFFFAOYSA-N

InChI: InChI=1S/C7H10O2/c8-5-6-1-3-7(9)4-2-6/h5-6H,1-4H2

Product No.
Description
Grade & Purity (?)

O196114
4-Oxocyclohexanecarbaldehyde
- ≥95%
| Pricing Close

: Ligustrazine Hydrochloride
2 Citations

Cas Number: 76494-51-4

Formula: C₈H₁₃ClN₂

Molecular weight: 172.66

Synonyms: Ligustrazine hydrochloride|76494-51-4|Ligustrazine HCl|2,3,5,6-tetramethylpyrazine hydrochloride|2,3...

SMILES: CC1=C(N=C(C(=N1)C)C)C.Cl

InChIKey: RQKFOGXUTRDQPB-UHFFFAOYSA-N

InChI: InChI=1S/C8H12N2.ClH/c1-5-6(2)10-8(4)7(3)9-5;/h1-4H3;1H

Product No.
Description
Grade & Purity (?)

L425881
Ligustrazine Hydrochloride
- 10mM in DMSO
| Pricing Close

: 2-isopropyl-5-methylcyclohexanamine
Cas Number: 21411-81-4

Formula: C₁₀H₂₁N

Molecular weight: 155.28

Synonyms: NSC-243755 | 5-methyl-2-(propan-2-yl)cyclohexan-1-amine | 2-(Isopropyl)-5-methylcyclohexylamine | 5-...

SMILES: CC1CCC(C(C1)N)C(C)C

InChIKey: RBMUAGDCCJDQLE-UHFFFAOYSA-N

InChI: InChI=1S/C10H21N/c1-7(2)9-5-4-8(3)6-10(9)11/h7-10H,4-6,11H2,1-3H3

Product No.
Description
Grade & Purity (?)

I358703
2-isopropyl-5-methylcyclohexanamine
- ≥97%
| Pricing Close

: 3-Carboxy-4,5-difluorophenylboronic acid
Cas Number: 1217500-81-6

Formula: C₇H₅BF₂O₄

Molecular weight: 201.9

Synonyms: 3-CARBOXY-4,5-DIFLUOROPHENYLBORONIC ACID|1217500-81-6|5-borono-2,3-difluorobenzoic acid|SCHEMBL99387...

SMILES: B(C1=CC(=C(C(=C1)F)F)C(=O)O)(O)O

InChIKey: LGTXKMKWZQXDKJ-UHFFFAOYSA-N

InChI: InChI=1S/C7H5BF2O4/c9-5-2-3(8(13)14)1-4(6(5)10)7(11)12/h1-2,13-14H,(H,11,12)

Product No.
Description
Grade & Purity (?)

C180264
3-Carboxy-4,5-difluorophenylboronic acid
- ≥96%
| Pricing Close

: 5-(Chloromethyl)-3-methyl-1,2,4-oxadiazole
Cas Number: 1192-81-0

Formula: C₄H₅ClN₂O

Molecular weight: 132.55

Synonyms: 5-(chloromethyl)-3-methyl-1,2,4-oxadiazole|1192-81-0|1,2,4-OXADIAZOLE, 5-(CHLOROMETHYL)-3-METHYL-|MF...

SMILES: CC1=NOC(=N1)CCl

InChIKey: FYDQQEVRVKAASZ-UHFFFAOYSA-N

InChI: InChI=1S/C4H5ClN2O/c1-3-6-4(2-5)8-7-3/h2H2,1H3

Product No.
Description
Grade & Purity (?)

D302540
5-(Chloromethyl)-3-methyl-1,2,4-oxadiazole
- ≥97%
| Pricing Close