Cas no 99681-64-8 (p-(p-Acetoxybenzoyloxy)benzoic acid benzyl ester)
99681-64-8 structure
Product Name:p-(p-Acetoxybenzoyloxy)benzoic acid benzyl ester
CAS No:99681-64-8
MF:C23H18O6
MW:390.385426998138
CID:1992811
PubChem ID:13587739
Update Time:2025-04-21
p-(p-Acetoxybenzoyloxy)benzoic acid benzyl ester Chemical and Physical Properties
Names and Identifiers
-
- p-(p-Acetoxybenzoyloxy)benzoic acid benzyl ester
- (4-phenylmethoxycarbonylphenyl) 4-acetyloxybenzoate
- 99681-64-8
- DTXSID90544488
- benzyl p-(p-acetoxybenzoyloxy)benzoate
- STOLHTSXPDNJJX-UHFFFAOYSA-N
- SCHEMBL10709793
- 4-[(Benzyloxy)carbonyl]phenyl 4-(acetyloxy)benzoate
-
- Inchi: 1S/C23H18O6/c1-16(24)28-20-11-9-19(10-12-20)23(26)29-21-13-7-18(8-14-21)22(25)27-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3
- InChI Key: STOLHTSXPDNJJX-UHFFFAOYSA-N
- SMILES: O(C(C1C=CC(=CC=1)OC(C1C=CC(=CC=1)OC(C)=O)=O)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 390.11033829g/mol
- Monoisotopic Mass: 390.11033829g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 29
- Rotatable Bond Count: 9
- Complexity: 552
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.1
- Topological Polar Surface Area: 78.9?2
p-(p-Acetoxybenzoyloxy)benzoic acid benzyl ester Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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