Cas no 2902-59-2 (Benzenepropanoic acid, a,a-diphenyl-, ethyl ester)
2902-59-2 structure
Product Name:Benzenepropanoic acid, a,a-diphenyl-, ethyl ester
CAS No:2902-59-2
MF:C23H22O2
MW:330.419586658478
CID:291141
PubChem ID:253026
Update Time:2025-04-19
Benzenepropanoic acid, a,a-diphenyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanoic acid, a,a-diphenyl-, ethyl ester
- ethyl 2,2,3-triphenylpropanoate
- 2,2,3-Triphenyl-propionsaeure-ethylester
- Diphenyl-benzyl-essigsaeure-ethylester
- NSC-75401
- NSC75401
- 2902-59-2
- DTXSID90291425
- SCHEMBL2995040
-
- Inchi： 1S/C23H22O2/c1-2-25-22(24)23(20-14-8-4-9-15-20,21-16-10-5-11-17-21)18-19-12-6-3-7-13-19/h3-17H,2,18H2,1H3
- InChI Key： MNSMDJQFEBWHQU-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C1C=CC=CC=1)(C1C=CC=CC=1)CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 330.16200
- Monoisotopic Mass: 330.162
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 7
- Complexity: 380
- 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: 5.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.101
- Boiling Point: 423.7°Cat760mmHg
- Flash Point: 132.3°C
- Refractive Index: 1.58
- PSA: 26.30000
- LogP: 4.77850
Benzenepropanoic acid, a,a-diphenyl-, ethyl ester Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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