| 2D Structure | |
| CID | 12348 |
| Target | ACHE , CYP2C19 , CYP2C9 , GLI3 , HSPB1 , NR1I3 , RXRA |
| IUPAC Name | pentyl acetate |
| InChI | InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3 |
| InChI Key | PGMYKACGEOXYJE-UHFFFAOYSA-N |
| Canonical SMILES | CCCCCOC(=O)C |
| Isomeric SMILES | CCCCCOC(=O)C |
| Molecular Formula | C7H14O2 |
| Molecular Weight | 130.18 |
| synonyms | ['Amyl acetate', 'Pentyl acetate', '628-63-7', 'n-Amyl acetate', 'N-PENTYL ACETATE', 'Acetic acid, pentyl ester', 'Amyl acetic ester', '1-Pentyl acetate', 'Birnenoel', 'n-Pentyl ethanoate', 'Acetic acid, amyl ester', 'Amyl acetic ether', 'Amylazetat', 'Pent-acetate 28', '1-Pentanol acetate', 'Octan amylu', "Acetate d'amyle", 'Primary amyl acetate', 'Prim-amyl acetate', 'Amylazetat [German]', 'Holiday Pet Repellent', 'Holiday Repellent Dust', 'Octan amylu [Polish]', 'Caswell No. 049A', '1-Acetoxypentane', 'n-Amyl acetate, normal', 'Amylester kyseliny octove', "Acetate d'amyle [French]", 'NSC 7923', '1-Pentanol, acetate', 'Amyl acetates', 'Dymon SWH Wasp & Hornet Spray', 'HSDB 5126', 'Amylester kyseliny octove [Czech]', 'n-Amyl acetate, normal (natural)', 'Pentyl ester of acetic acid', 'EINECS 211-047-3', 'EPA Pesticide Chemical Code 000169', 'BRN 1744753', '92Q24NH7AS', 'DTXSID1027263', 'CHEBI:87362', 'AI3-02729', 'NSC-7923', 'Acetic acid, N-amyl ester', 'AMYL ACETATE [II]', 'AMYL ACETATE [MART.]', 'N-AMYL ACETATE [HSDB]', 'DTXCID107263', '4-02-00-00152 (Beilstein Handbook Reference)', 'AMYL ACETATE (II)', 'AMYLAZETAT (GERMAN)', 'OCTAN AMYLU (POLISH)', 'AMYL ACETATE (MART.)', "ACETATE D'AMYLE (FRENCH)", 'Amylester kyseliny octove (Czech)', 'PENTYL ACETATE (N) (AMYL ACETATE)', 'PENTYL ACETATE (N) {AMYL ACETATE}', 'pentacetate', 'nPentyl acetate', 'nAmyl acetate', 'Primamyl acetate', '1Pentyl acetate', 'nPentyl ethanoate', 'Pentacetate 28', '1Pentanol acetate', 'Caswell No 049A', 'nAmyl acetate, normal', 'PENTYL ACETATES', 'AMYL ACETATE [INCI]', 'Acetic acid, 1-pentyl ester', 'n-Amyl acetate (ACGIH:OSHA)', 'nAmyl acetate, normal (natural)', 'AMYL ACETATE, MIXED ISOMERS', '211-047-3', 'inchi=1/c7h14o2/c1-3-4-5-6-9-7(2)8/h3-6h2,1-2h', 'Pent-acetate', 'Acetic acid pentyl ester', 'pentyl ethanoate', 'Acetic acid n-amyl ester', '828-63-7', 'MFCD00009500', 'Acetic acid, n-pentyl ester', 'Amyl acetate, n-', 'CAS-628-63-7', 'UN1104', 'Amyl acetate (commercial)', 'pentylethanoate', 'UNII-92Q24NH7AS', 'Pentyl acetate, 99%', 'Acetic Acid Amyl Ester', 'SCHEMBL10663', 'WLN: 5OV1', 'CHEMBL47769', 'Amyl acetate, >=99%, FG', 'NSC7923', 'Pentyl acetate, analytical standard', 'AAA62863', 'Tox21_201628', 'Tox21_300360', 'LMFA07010176', 'MSK000793', 'STL268857', 'AKOS009031544', 'NCGC00248005-01', 'NCGC00248005-02', 'NCGC00254285-01', 'NCGC00259177-01', 'A0021', 'NS00008926', 'Amyl acetates [UN1104] [Flammable liquid]', 'EN300-19874', 'A834045', 'Pentyl acetate, puriss. p.a., >=98.5% (GC)', 'Q416972', 'Z104475894'] |
From Pubchem