Search results for: '114457-94-2'

: N-(Pyrazinylcarbonyl)-L-phenylalanine
Cas Number: 114457-94-2

Formula: C₁₄H₁₃N₃O₃

Molecular weight: 271.28

Synonyms: 1093959-75-1 | SCHEMBL535687 | A803186 | AMY1063 | (2S)-3-Phenyl-2-[[(pyrazin-2-yl)carbonyl]amino]pr...

SMILES: C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=NC=CN=C2

InChIKey: DWYZPDHMMZGQAP-NSHDSACASA-N

InChI: InChI=1S/C14H13N3O3/c18-13(12-9-15-6-7-16-12)17-11(14(19)20)8-10-4-2-1-3-5-10/h1-7,9,11H,8H2,(H,17,18)(H,19,20)/t11-/m0/s1

Product No.
Description
Grade & Purity (?)

N159866
N-(Pyrazinylcarbonyl)-L-phenylalanine
- ≥98%(HPLC)
| Pricing Close

: Mianserin HCl
Cas Number: 21535-47-7(DMSO)

Formula: C₁₈H₂₀N₂·HCl

Molecular weight: 300.83

Synonyms: ORG GB-94 HCl | Dibenzo[c,f]pyrazino[1,2-a]azepine, 1,2,3,4,10,14b-hexahydro-2-methyl-, hydrochlorid...

SMILES: Cl.CN1CCN2C(C1)C3=C(CC4=C2C=CC=C4)C=CC=C3

Product No.
Description
Grade & Purity (?)

M408402
Mianserin HCl
- 10mM in DMSO
| Pricing Close

: 4-bromo-2-(oxetan-3-yloxy)pyridine
Cas Number: 1823965-94-1

Formula: C₈H₈NO₂Br

Molecular weight: 230.06

Synonyms: 4-bromo-2-(oxetan-3-yloxy)pyridine | 1823965-94-1 | P20847

SMILES: C1C(CO1)OC2=NC=CC(=C2)Br

InChIKey: KNJVQWDCBNMKIL-UHFFFAOYSA-N

InChI: InChI=1S/C8H8BrNO2/c9-6-1-2-10-8(3-6)12-7-4-11-5-7/h1-3,7H,4-5H2

Product No.
Description
Grade & Purity (?)

B637820
4-bromo-2-(oxetan-3-yloxy)pyridine
- ≥97%
| Pricing Close

: 1-(2-fluoroethyl)azetidin-3-amine
Cas Number: 1516698-94-4

Synonyms: 3-Azetidinamine, 1-(2-fluoroethyl)-, dihydrochloride | 1516698-94-4 | SB13575 | 1-(2-Fluoroethyl)aze...

SMILES: C1C(CN1CCF)N.Cl.Cl

InChIKey: VRDJHKTWBIHJFC-UHFFFAOYSA-N

InChI: InChI=1S/C5H11FN2.2ClH/c6-1-2-8-3-5(7)4-8;;/h5H,1-4,7H2;2*1H

Product No.
Description
Grade & Purity (?)

A637676
1-(2-fluoroethyl)azetidin-3-amine
- ≥97%
| Pricing Close

: 2-methylindazole-4-carboxamide
Cas Number: 2306264-94-6

Formula: C₉H₉N₃O

Molecular weight: 175.19

Synonyms: 2-methylindazole-4-carboxamide | 2306264-94-6 | SCHEMBL22723833 | 2-methyl-2H-indazole-4-carboxamide...

SMILES: CN1C=C2C(=N1)C=CC=C2C(=O)N

InChIKey: HMTNRSCZGLVGLC-UHFFFAOYSA-N

InChI: InChI=1S/C9H9N3O/c1-12-5-7-6(9(10)13)3-2-4-8(7)11-12/h2-5H,1H3,(H2,10,13)

Product No.
Description
Grade & Purity (?)

M637993
2-methylindazole-4-carboxamide
- ≥97%
| Pricing Close

: 2-(3-methoxyoxetan-3-yl)ethan-1-ol
Cas Number: 1609489-94-2

Formula: C₆H₁₂O₃

Molecular weight: 132.16

Synonyms: 2-(3-methoxyoxetan-3-yl)ethan-1-ol | 1609489-94-2 | MFCD31697620 | SB40964 | P18427

SMILES: COC1(COC1)CCO

InChIKey: VTUNHKACBUEYGK-UHFFFAOYSA-N

InChI: InChI=1S/C6H12O3/c1-8-6(2-3-7)4-9-5-6/h7H,2-5H2,1H3

Product No.
Description
Grade & Purity (?)

E629805
2-(3-methoxyoxetan-3-yl)ethan-1-ol
- ≥97%
| Pricing Close

: (3R)-3-ethynylpiperidine;hydrochloride
Cas Number: 2306254-94-2

Synonyms: (3R)-3-ethynylpiperidine | hydrochloride | 2306254-94-2 | (3R)-3-ETHYNYLPIPERIDINE HYDROCHLORIDE | F...

SMILES: C#CC1CCCNC1.Cl

InChIKey: DOVRPBHQYGSJIU-FJXQXJEOSA-N

InChI: InChI=1S/C7H11N.ClH/c1-2-7-4-3-5-8-6-7;/h1,7-8H,3-6H2;1H/t7-;/m0./s1

Product No.
Description
Grade & Purity (?)

E632632
(3R)-3-ethynylpiperidine;hydrochloride
- ≥97%
| Pricing Close

: Mianserin HCl
1 Citations

Cas Number: 21535-47-7 EC Number: 244-426-7

Formula: C₁₈H₂₀N₂·HCl

Molecular weight: 300.83

Synonyms: 1,2,3,4,10,14b-Hexahydro-2-methyldibenzo[c,f]-pyrazino[1,2-a]azepine monohydrochloride | MIANSERIN H...

SMILES: CN1CCN2C(C1)C3=CC=CC=C3CC4=CC=CC=C42.Cl

InChIKey: YNPFMWCWRVTGKJ-UHFFFAOYSA-N

InChI: InChI=1S/C18H20N2.ClH/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19;/h2-9,18H,10-13H2,1H3;1H

Product No.
Description
Grade & Purity (?)

M129226
Mianserin HCl
- ≥98%
| Pricing Close

: NSC 31153
Cas Number: 6325-94-6

Formula: C₁₀H₇NO₃S

Molecular weight: 221.23

Synonyms: 5-[(2-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione|6325-94-6|5-(2-hydroxybenzylidene)-1,3-t...

SMILES: C1=CC=C(C(=C1)C=C2C(=O)NC(=O)S2)O

InChIKey: IZVVCHFDGJEVTB-UHFFFAOYSA-N

InChI: InChI=1S/C10H7NO3S/c12-7-4-2-1-3-6(7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)

Product No.
Description
Grade & Purity (?)

N412277
NSC 31153
- ≥98%
| Pricing Close

: 5-fluoro-1,3-benzoxazole-2-carboxylic acid;sodium salt
Cas Number: 2387599-94-0

Synonyms: Sodium 5-fluoro-1,3-benzoxazole-2-carboxylate | Sodium 5-fluorobenzo[d]oxazole-2-carboxylate | 23875...

SMILES: C1=CC2=C(C=C1F)N=C(O2)C(=O)[O-].[Na+]

InChIKey: FQZOOEDAJQZPHN-UHFFFAOYSA-M

InChI: InChI=1S/C8H4FNO3.Na/c9-4-1-2-6-5(3-4)10-7(13-6)8(11)12;/h1-3H,(H,11,12);/q;+1/p-1

Product No.
Description
Grade & Purity (?)

F635823
5-fluoro-1,3-benzoxazole-2-carboxylic acid;sodium salt
- ≥97%
| Pricing Close

: (S)-(+)-2-Heptyl isothiocyanate
Synonyms: (S)-(+)-2-Heptyl isothiocyanate|737000-94-1|(2S)-2-ISOTHIOCYANATOHEPTANE|DTXSID60426868|MFCD05664052...

SMILES: CCCCCC(C)N=C=S

InChIKey: UPTLUDLHIIYPNC-QMMMGPOBSA-N

InChI: InChI=1S/C8H15NS/c1-3-4-5-6-8(2)9-7-10/h8H,3-6H2,1-2H3/t8-/m0/s1

Product No.
Description
Grade & Purity (?)

S300503
(S)-(+)-2-Heptyl isothiocyanate
- ≥98%
| Pricing Close

: 6-Bromofuro[3,2-b]pyridine-2-carbonitrile
Cas Number: 1203498-94-5

Formula: C₈H₃BrN₂O

Molecular weight: 223.03

Synonyms: 1203498-94-5 | MFCD13563100 | DTXSID70673644 | AKOS015834523 | 6-Bromofuro[3,2-b]pyridine-2-carbonit...

SMILES: C1=C(C=NC2=C1OC(=C2)C#N)Br

InChIKey: DCCFLNQLIYYNHQ-UHFFFAOYSA-N

InChI: InChI=1S/C8H3BrN2O/c9-5-1-8-7(11-4-5)2-6(3-10)12-8/h1-2,4H

Product No.
Description
Grade & Purity (?)

B166417
6-Bromofuro[3,2-b]pyridine-2-carbonitrile
| Pricing Close

: 3,3-difluoro-2-phenylazetidine
Cas Number: 915190-94-2

Formula: C₉H₉F₂N

Molecular weight: 169.18

Synonyms: 3,3-difluoro-2-phenylazetidine | 915190-94-2 | Azetidine, 3,3-difluoro-2-phenyl- | SCHEMBL19471123 |...

SMILES: C1C(C(N1)C2=CC=CC=C2)(F)F

InChIKey: SXIWYYFFWQSQIJ-UHFFFAOYSA-N

InChI: InChI=1S/C9H9F2N/c10-9(11)6-12-8(9)7-4-2-1-3-5-7/h1-5,8,12H,6H2

Product No.
Description
Grade & Purity (?)

D635104
3,3-difluoro-2-phenylazetidine
- ≥97%
| Pricing Close

: Phenethylammonium bromide
1 Citations

Cas Number: 53916-94-2

Formula: C₈H₁₂BrN

Molecular weight: 202.09

Synonyms: 2-Phenylethylamine hydrobromide|53916-94-2|Benzeneethanamine, hydrobromide|2-phenylethanamine;hydrob...

SMILES: C1=CC=C(C=C1)CCN.Br

InChIKey: IRAGENYJMTVCCV-UHFFFAOYSA-N

InChI: InChI=1S/C8H11N.BrH/c9-7-6-8-4-2-1-3-5-8;/h1-5H,6-7,9H2;1H

Product No.
Description
Grade & Purity (?)

P408003
Phenethylammonium bromide
- ≥98%
| Pricing Close

: 5-bromo-2-chloro-3-methyl-pyrazine
Cas Number: 112930-94-6

Formula: C₅H₄N₂ClBr

Molecular weight: 207.46

Synonyms: 5-BROMO-2-CHLORO-3-METHYLPYRAZINE | 112930-94-6 | SCHEMBL22678131 | MFCD18250182 | AKOS025395504 | A...

SMILES: CC1=NC(=CN=C1Cl)Br

InChIKey: RWDYAMJQLRNUCM-UHFFFAOYSA-N

InChI: InChI=1S/C5H4BrClN2/c1-3-5(7)8-2-4(6)9-3/h2H,1H3

Product No.
Description
Grade & Purity (?)

B626933
5-bromo-2-chloro-3-methyl-pyrazine
- ≥97%
| Pricing Close

: 1-Bromo-3-ethoxy-2-iodobenzene
Cas Number: 1072944-94-5

Formula: C8H8BrIO

Molecular weight: 327

Synonyms: 1-bromo-3-ethoxy-2-iodobenzene|1072944-94-5|C8H8BrIO|DTXSID40670327|XSB94494|MFCD11504954|AKOS015834...

SMILES: CCOC1=C(C(=CC=C1)Br)I

InChIKey: VFVWGSAUFKCRRF-UHFFFAOYSA-N

InChI: InChI=1S/C8H8BrIO/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2H2,1H3

Product No.
Description
Grade & Purity (?)

B179175
1-Bromo-3-ethoxy-2-iodobenzene
- ≥98%
| Pricing Close

: 2-(chloromethyl)cyclopropane-1-carboxylic acid
Cas Number: 1779806-94-8

Formula: C₅H₇ClO₂

Molecular weight: 134.56

Synonyms: 2-(CHLOROMETHYL)CYCLOPROPANE-1-CARBOXYLIC ACID | 1779806-94-8 | 2-(chloromethyl)cyclopropanecarboxyl...

SMILES: C1C(C1C(=O)O)CCl

InChIKey: UTMFMZALCNUPDJ-UHFFFAOYSA-N

InChI: InChI=1S/C5H7ClO2/c6-2-3-1-4(3)5(7)8/h3-4H,1-2H2,(H,7,8)

Product No.
Description
Grade & Purity (?)

C630331
2-(chloromethyl)cyclopropane-1-carboxylic acid
- ≥97%
| Pricing Close

: R(+)-IAA-94
Cas Number: 54197-31-8

Formula: C₁₇H₁₈Cl₂O₄

Molecular weight: 357.23

Synonyms: R(+)-Methylindazone | (S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)ox...

SMILES: CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3CCCC3

InChIKey: RNOJGTHBMJBOSP-KRWDZBQOSA-N

InChI: InChI=1S/C17H18Cl2O4/c1-17(10-4-2-3-5-10)7-9-6-11(23-8-12(20)21)14(18)15(19)13(9)16(17)22/h6,10H,2-5,7-8H2,1H3,(H,20,21)/t17-/m0/s1

Product No.
Description
Grade & Purity (?)

I345659
R(+)-IAA-94
- ≥98%
| Pricing Close

: (2-Carboxyethyl)triphenylphosphonium bromide
Cas Number: 51114-94-4

Formula: C₂₁H₂₀BrO₂P

Molecular weight: 415.26

Synonyms: (2-Carboxyethyl)triphenylphosphonium bromide|51114-94-4|2-Carboxyethyl triphenylphosponium bromide|2...

SMILES: C1=CC=C(C=C1)[P+](CCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChIKey: BVKRDNIULHRLCO-UHFFFAOYSA-N

InChI: InChI=1S/C21H19O2P.BrH/c22-21(23)16-17-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;/h1-15H,16-17H2;1H

Product No.
Description
Grade & Purity (?)

C193663
(2-Carboxyethyl)triphenylphosphonium bromide
- ≥98%
| Pricing Close

: 1-(4-methylpiperazin-1-yl)cyclopropanecarboxylic acid;dihydrochloride
Cas Number: 2484905-94-2

Synonyms: D79087 | 1-(4-Methylpiperazin-1-yl)cyclopropanecarboxylic acid diHCl | 1-(4-METHYLPIPERAZIN-1-YL)CYC...

SMILES: CN1CCN(CC1)C2(CC2)C(=O)O.Cl.Cl

InChIKey: PJWJSGAKAWCFQP-UHFFFAOYSA-N

InChI: InChI=1S/C9H16N2O2.2ClH/c1-10-4-6-11(7-5-10)9(2-3-9)8(12)13;;/h2-7H2,1H3,(H,12,13);2*1H

Product No.
Description
Grade & Purity (?)

C638040
1-(4-methylpiperazin-1-yl)cyclopropanecarboxylic acid;dihydrochloride
- ≥97%
| Pricing Close

: 5-Chloro-2-ethoxy-3-fluoropyridine
Cas Number: 886373-94-0

Formula: C₇H₇ClFNO

Molecular weight: 175.6

Synonyms: 5-CHLORO-2-ETHOXY-3-FLUOROPYRIDINE|886373-94-0|SCHEMBL2452622|DTXSID10674392|MFCD07375054|AKOS006285...

SMILES: CCOC1=C(C=C(C=N1)Cl)F

InChIKey: VWGBQMRDTSDSKE-UHFFFAOYSA-N

InChI: InChI=1S/C7H7ClFNO/c1-2-11-7-6(9)3-5(8)4-10-7/h3-4H,2H2,1H3

Product No.
Description
Grade & Purity (?)

C187744
5-Chloro-2-ethoxy-3-fluoropyridine
- ≥97%
| Pricing Close

: 2-amino-4-bromo-3-chloro-6-fluoro-benzonitrile
Cas Number: 2250339-94-5

Formula: C₇H₃N₂FClBr

Molecular weight: 249.47

Synonyms: 2-amino-4-bromo-3-chloro-6-fluoro-benzonitrile | 2250339-94-5 | 2-Amino-4-bromo-3-chloro-6-fluoroben...

SMILES: C1=C(C(=C(C(=C1Br)Cl)N)C#N)F

InChIKey: WTEVGNNNPFJCHX-UHFFFAOYSA-N

InChI: InChI=1S/C7H3BrClFN2/c8-4-1-5(10)3(2-11)7(12)6(4)9/h1H,12H2

Product No.
Description
Grade & Purity (?)

A637972
2-amino-4-bromo-3-chloro-6-fluoro-benzonitrile
- ≥97%
| Pricing Close

: 3-Butoxy-2-fluorophenylboronic acid
Cas Number: 871125-94-9

Formula: C₁₀H₁₄BFO₃

Molecular weight: 212

Synonyms: 871125-94-9|(3-Butoxy-2-fluorophenyl)boronic acid|3-Butoxy-2-fluorophenylboronic acid|(3-Butoxy-2-fl...

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

InChIKey: WNJLIXXAMYHSLC-UHFFFAOYSA-N

InChI: InChI=1S/C10H14BFO3/c1-2-3-7-15-9-6-4-5-8(10(9)12)11(13)14/h4-6,13-14H,2-3,7H2,1H3

Product No.
Description
Grade & Purity (?)

B187308
3-Butoxy-2-fluorophenylboronic acid
- ≥98%
| Pricing Close

: tert-butyl 2-allylazepane-1-carboxylate
Cas Number: 153749-94-1

Formula: C₁₄H₂₅NO₂

Molecular weight: 239.35

Synonyms: F89724 | 2-Allylhexahydro-1H-azepine-1-carboxylic acid tert-butyl ester | TERT-BUTYL 2-(PROP-2-EN-1-...

SMILES: CC(C)(C)OC(=O)N1CCCCCC1CC=C

InChIKey: SEUOPPALBOQXNQ-UHFFFAOYSA-N

InChI: InChI=1S/C14H25NO2/c1-5-9-12-10-7-6-8-11-15(12)13(16)17-14(2,3)4/h5,12H,1,6-11H2,2-4H3

Product No.
Description
Grade & Purity (?)

T629616
tert-butyl 2-allylazepane-1-carboxylate
- ≥97%
| Pricing Close