Cas no 134098-88-7 (Benzoic acid, 2-benzoyl-3,6-dimethyl-, propyl ester)
134098-88-7 structure
Product Name:Benzoic acid, 2-benzoyl-3,6-dimethyl-, propyl ester
CAS No:134098-88-7
MF:C19H20O3
MW:296.360305786133
CID:1235016
Update Time:2024-08-05
Benzoic acid, 2-benzoyl-3,6-dimethyl-, propyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-benzoyl-3,6-dimethyl-, propyl ester
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- Inchi： 1S/C19H20O3/c1-4-12-22-19(21)17-14(3)11-10-13(2)16(17)18(20)15-8-6-5-7-9-15/h5-11H,4,12H2,1-3H3
- InChI Key： OCPRKMBBSZTHOE-UHFFFAOYSA-N
- SMILES： C(OCCC)(=O)C1=C(C)C=CC(C)=C1C(=O)C1=CC=CC=C1
Computed Properties
- Exact Mass: 296.1413
Experimental Properties
- Density: 1.093±0.06 g/cm3(Predicted)
- Boiling Point: 397.1±30.0 °C(Predicted)
- PSA: 43.37
Benzoic acid, 2-benzoyl-3,6-dimethyl-, propyl ester Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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