Phenol esters

Metipranolol hydrochloride

Grade & Purity:

≥99%

Cas Number: 36592-77-5 Compound CID: 656682

Formula: C₁₇H₂₈ClNO₄ Molecular Weight: 345.86

IUPAC Name: [4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl] acetate;hydrochloride

SMILES: CC1=CC(=C(C(=C1OC(=O)C)C)C)OCC(CNC(C)C)O.Cl

InChIKey: BLWNYSZZZWQCKO-UHFFFAOYSA-N

InChI: InChI=1S/C17H27NO4.ClH/c1-10(2)18-8-15(20)9-21-16-7-11(3)17(22-14(6)19)13(5)12(16)4;/h7,10,15,18,20H,8-9H2,1-6H3;1H

Synonyms: METIPRANOLOL HYDROCHLORIDE | MS-25314 | PHENOL, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-2,3,6-TRIMETHYL-, 1-ACE...

Details

Pricing Close

Oxyphenisatin acetate

Grade & Purity:

Moligand™

≥98%

Cas Number: 115-33-3 Compound CID: 8269

Formula: C₂₄H₁₉NO₅ Molecular Weight: 401.41

IUPAC Name: [4-[3-(4-acetyloxyphenyl)-2-oxo-1H-indol-3-yl]phenyl] acetate

SMILES: CC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3NC2=O)C4=CC=C(C=C4)OC(=O)C

InChIKey: PHPUXYRXPHEJDF-UHFFFAOYSA-N

InChI: InChI=1S/C24H19NO5/c1-15(26)29-19-11-7-17(8-12-19)24(18-9-13-20(14-10-18)30-16(2)27)21-5-3-4-6-22(21)25-23(24)28/h3-14H,1-2H3,(H,25,28)

Synonyms: 3,3-Bis(p-acetoxyphenyl)oxindole | CHEBI:135638 | Oxyphenisatine di(acetate) | Diphesatine | OXYPHENISATIN ACETATE [M...

Details

Pricing Close

Meptyldinocap

Grade & Purity:

≥95%

Cas Number: 131-72-6

Formula: C₁₈H₂₄N₂O₆ Molecular Weight: 364.39

IUPAC Name: (2,4-dinitro-6-octan-2-ylphenyl) (E)-but-2-enoate

SMILES: CCCCCCC(C)C1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C=CC

InChIKey: NIOPZPCMRQGZCE-WEVVVXLNSA-N

InChI: InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+

Synonyms: 2,4-dinitro-6-(octan-2-yl)phenyl (E)-but-2-enoate | AI3-24727 | Meptyldinocap, PESTANAL(R), analytical standard | UNI...

Details

Pricing Close

Cyclooctyne-O-PFP ester

Grade & Purity:

≥95%

Cas Number: 886209-60-5 Compound CID: 59511122

Formula: C₁₆H₁₃F₅O₃ Molecular Weight: 348.26

IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 2-cyclooct-2-yn-1-yloxyacetate

SMILES: C1CCC#CC(CC1)OCC(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

InChIKey: FTKRNGMQMZGSDF-UHFFFAOYSA-N

InChI: InChI=1S/C16H13F5O3/c17-11-12(18)14(20)16(15(21)13(11)19)24-10(22)8-23-9-6-4-2-1-3-5-7-9/h9H,1-4,6,8H2

Details

Pricing Close

(2-bromo-4-methyl-phenyl) propanoate

Grade & Purity:

≥97%

Cas Number: 939533-80-9 Compound CID: 19184220

Formula: C₁₀H₁₁O₂Br Molecular Weight: 243.1

IUPAC Name: (2-bromo-4-methylphenyl) propanoate

SMILES: CCC(=O)OC1=C(C=C(C=C1)C)Br

InChIKey: PRPRTIJMLABJHC-UHFFFAOYSA-N

InChI: InChI=1S/C10H11BrO2/c1-3-10(12)13-9-5-4-7(2)6-8(9)11/h4-6H,3H2,1-2H3

Synonyms: (2-bromo-4-methyl-phenyl) propanoate | 939533-80-9 | SCHEMBL23887393 | AKOS003027718 | 2-BROMO-4-METHYLPHENYL PROPANO...

Details

Pricing Close

4'-Acetoxyacetanilide

Grade & Purity:

≥95%

Cas Number: 2623-33-8

Formula: C₁₀H₁₁NO₃ Molecular Weight: 193.2

IUPAC Name: (4-acetamidophenyl) acetate

SMILES: CC(=O)NC1=CC=C(C=C1)OC(=O)C

InChIKey: UJAOSPFULOFZRR-UHFFFAOYSA-N

InChI: InChI=1S/C10H11NO3/c1-7(12)11-9-3-5-10(6-4-9)14-8(2)13/h3-6H,1-2H3,(H,11,12)

Details

Pricing Close

Phenyl Butyrate

Grade & Purity:

Moligand™

≥97%

Cas Number: 4346-18-3 EC Number: 224-405-9

Formula: C₁₀H₁₂O₂ Molecular Weight: 164.20

IUPAC Name: phenyl butanoate

SMILES: CCCC(=O)OC1=CC=CC=C1

InChIKey: IGVPBCZDHMIOJH-UHFFFAOYSA-N

InChI: InChI=1S/C10H12O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3

Synonyms: Butanoic Acid Phenyl Ester | Phenyl Butanoate | AI3 11761 | AI311761 | AI3-11761

Details

Pricing Close

3-(prop-2-en-1-yl)-4-{3-[(propan-2-yl)amino]propoxy}phenyl propanoate

Grade & Purity:

Moligand™

IUPAC Name: 3-(prop-2-en-1-yl)-4-{3-[(propan-2-yl)amino]propoxy}phenyl propanoate

SMILES: C=CCc1cc(ccc1OCCCNC(C)C)OC(=O)CC

InChIKey: TYOWLIKQVJJCEX-UHFFFAOYSA-N

InChI: InChI=1S/C18H27NO3/c1-5-8-15-13-16(22-18(20)6-2)9-10-17(15)21-12-7-11-19-14(3)4/h5,9-10,13-14,19H,1,6-8,11-12H2,2-4H3

Synonyms: compound 19

Details

Pricing Close

metipranolol

Grade & Purity:

Moligand™

Cas Number: 22664-55-7 EC Number: 245-151-5 Compound CID: 31477

IUPAC Name: [4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl] acetate

SMILES: CC1=CC(=C(C(=C1OC(=O)C)C)C)OCC(CNC(C)C)O

InChIKey: BQIPXWYNLPYNHW-UHFFFAOYSA-N

InChI: InChI=1S/C17H27NO4/c1-10(2)18-8-15(20)9-21-16-7-11(3)17(22-14(6)19)13(5)12(16)4/h7,10,15,18,20H,8-9H2,1-6H3

Details

Pricing Close

dipivefrine

Grade & Purity:

Moligand™

≥98%

Cas Number: 52365-63-6 Compound CID: 3105

Formula: C₁₉H₂₉NO₅ Molecular Weight: 351.44

IUPAC Name: 2-[(2,2-dimethylpropanoyl)oxy]-4-[1-hydroxy-2-(methylamino)ethyl]phenyl 2,2-dimethylpropanoate

SMILES: CNCC(c1ccc(c(c1)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)O

InChIKey: OCUJLLGVOUDECM-UHFFFAOYSA-N

InChI: InChI=1S/C19H29NO5/c1-18(2,3)16(22)24-14-9-8-12(13(21)11-20-7)10-15(14)25-17(23)19(4,5)6/h8-10,13,20-21H,11H2,1-7H3

Synonyms: Dipivefrinum | 2,2-Dimethylpropanoic acid 4-[1-hydroxy-2-(methylamino)ethyl]-1,2-phenylene ester | BPBio1_000688 | 4-...

Details

Pricing Close

CpdA (parent molecule)

Grade & Purity:

Moligand™

Cas Number: 136529-69-6 Compound CID: 9838148

IUPAC Name: [4-[1-chloro-2-(methylamino)ethyl]phenyl] acetate

SMILES: CNCC(c1ccc(cc1)OC(=O)C)Cl

InChIKey: VZCQEZNQVVYTJC-UHFFFAOYSA-N

InChI: InChI=1S/C11H14ClNO2/c1-8(14)15-10-5-3-9(4-6-10)11(12)7-13-2/h3-6,11,13H,7H2,1-2H3

Details

Pricing Close

Mal-amido-PEG12-TFP ester

Grade & Purity:

≥95%

Cas Number: 1431295-77-0 Compound CID: 91757744

Formula: C₄₀H₆₀N₂O₁₇F₄ Molecular Weight: 916.9

IUPAC Name: (2,3,5,6-tetrafluorophenyl) 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]etshow more

SMILES: C1=CC(=O)N(C1=O)CCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)OC2=C(C(=CC(=C2F)F)F)F

InChIKey: TYRMHYMPAXBKTH-UHFFFAOYSA-N

InChI: InChI=1S/C40H60F4N2O17/c41-32-31-33(42)39(44)40(38(32)43)63-37(50)4-7-51-9-11-53-13-15-55-17-19-57-21-23-59-25-27-61-29-30-62-28-26-60-24-22-58-20-18-show more

Details

Pricing Close

Phenol esters

Description:

Ancestors: