| 2D Structure | |
| CID | 8698 |
| Target | ESR1 |
| IUPAC Name | butyl benzoate |
| InChI | InChI=1S/C11H14O2/c1-2-3-9-13-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChI Key | XSIFPSYPOVKYCO-UHFFFAOYSA-N |
| Canonical SMILES | CCCCOC(=O)C1=CC=CC=C1 |
| Isomeric SMILES | CCCCOC(=O)C1=CC=CC=C1 |
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.23 |
| synonyms | ['BUTYL BENZOATE', 'n-Butyl benzoate', 'Benzoic acid, butyl ester', 'Anthrapole AZ', 'Dai Cari XBN', 'Benzoic acid n-butyl ester', 'Butylester kyseliny benzoove', 'NSC 8474', 'HSDB 2089', 'UNII-1TGZ0D0O8I', 'Butyl ester of benzoic acid', 'Butylester kyseliny benzoove [Czech]', 'EINECS 205-252-7', '1TGZ0D0O8I', 'Hipochem B-3-M', 'Marvanol Carrier BB', 'BRN 1867073', 'DTXSID8040694', 'AI3-00521', 'NSC-8474', 'BUTYL BENZOATE [HSDB]', 'N-BUTYL BENZOATE [MI]', 'DTXCID6020694', 'CHEBI:156070', '4-09-00-00290 (Beilstein Handbook Reference)', 'nButyl benzoate', 'Benzoic acid nbutyl ester', 'BUTYL BENZOATE [INCI]', '205-252-7', 'xsifpsypovkyco-uhfffaoysa-n', '136-60-7', 'Benzoic Acid Butyl Ester', 'MFCD00009439', 'n_butyl benzoate', '4-butyl benzoate', 'Benzoic acid n-butyl ester; Butyl benzoate; Chemcryl C 101N; IP Carrier N 20; NSC 8474; n-Butyl benzoate', 'Butyl benzoate, 99%', 'benzoic acid-butyl ester', 'benzoic acid n_butyl ester', 'Butyl benzoate, >=98%', 'WLN: 4OVR', 'SCHEMBL97514', 'CHEMBL1868953', 'NSC8474', 'Butyl benzoate, analytical standard', 'AAA13660', 'Tox21_300510', 'STL453779', 'AKOS009028883', 'HY-W016599', 'NCGC00163973-01', 'NCGC00163973-02', 'NCGC00254500-01', 'CAS-136-60-7', 'LS-13962', 'B0066', 'NS00012027', 'EN300-19222', 'F71163', 'Q818506', 'F8880-4634', 'Z104473208'] |
From Pubchem