Cas no 35282-98-5 (Benzenepropanoic acid, a,b-dibromo-2-chloro-, ethyl ester)
35282-98-5 structure
Product Name:Benzenepropanoic acid, a,b-dibromo-2-chloro-, ethyl ester
CAS No:35282-98-5
MF:C11H11Br2ClO2
MW:370.464841127396
CID:318662
PubChem ID:349041
Update Time:2025-04-19
Benzenepropanoic acid, a,b-dibromo-2-chloro-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanoic acid, a,b-dibromo-2-chloro-, ethyl ester
- ethyl 2,3-dibromo-3-(2-chlorophenyl)propanoate
- 2-(2-Chlorphenyl)-1,2-dibrompropionsaeureethylester
- AC1L8AK2
- NSC408590
- NSC-408590
- 35282-98-5
- DTXSID60325089
-
- Inchi： 1S/C11H11Br2ClO2/c1-2-16-11(15)10(13)9(12)7-5-3-4-6-8(7)14/h3-6,9-10H,2H2,1H3
- InChI Key： GXESVHOGRBTVJS-UHFFFAOYSA-N
- SMILES： BrC(C1C=CC=CC=1Cl)C(C(=O)OCC)Br
Computed Properties
- Exact Mass: 367.88143
- Monoisotopic Mass: 367.88143g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 238
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
- LogP: 4.10260
Benzenepropanoic acid, a,b-dibromo-2-chloro-, ethyl ester Related Literature
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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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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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