Cas no 144616-14-8 (Propanedioic acid, (2-chlorophenyl)-)
144616-14-8 structure
Product Name:Propanedioic acid, (2-chlorophenyl)-
CAS No:144616-14-8
MF:C9H7ClO4
MW:214.60248208046
CID:3752004
PubChem ID:15786995
Update Time:2025-04-22
Propanedioic acid, (2-chlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, (2-chlorophenyl)-
- Propanedioic acid, 2-(2-chlorophenyl)-
- 2-(2-chlorophenyl)propanedioic acid
- DB-191467
- SCHEMBL1244293
- 144616-14-8
- o-chlorophenylmalonic acid
-
- Inchi： 1S/C9H7ClO4/c10-6-4-2-1-3-5(6)7(8(11)12)9(13)14/h1-4,7H,(H,11,12)(H,13,14)
- InChI Key： QUSOGWAELIXREI-UHFFFAOYSA-N
- SMILES： C(O)(=O)C(C1=CC=CC=C1Cl)C(O)=O
Computed Properties
- Exact Mass: 214.0032864Da
- Monoisotopic Mass: 214.0032864Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 227
- 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: 1.8
- Topological Polar Surface Area: 74.6?2
Propanedioic acid, (2-chlorophenyl)- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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