Cas no 69533-53-5 (3-(3,5-Dichlorophenyl)propanoic acid)
69533-53-5 structure
Product Name:3-(3,5-Dichlorophenyl)propanoic acid
CAS No:69533-53-5
MF:C9H8Cl2O2
MW:219.06462097168
CID:1075411
Update Time:2023-08-03
3-(3,5-Dichlorophenyl)propanoic acid Chemical and Physical Properties
Names and Identifiers
-
- [2H5]-Propranolol
- 3-(3,5-dichlorophenyl)propanoic acid
- 3-(3,5-DICHLORO-PHENYL)-PROPIONIC ACID
- benzenepropanoic acid, 3,5-dichloro-
- 3-(3,5-Dichlorophenyl)propionic acid
- 3,5-Dichloro-benzenepropanoic acid
- 3-(3',5'-dichlorophenyl)propanoic acid
- 6410AC
- SBB095709
- 3-(3,5-di-chlorophenyl)propionic acid
- 3-(3,5-Dichloro-phenyl)-propionicacid
- 3-(3,5-dichlorophenyl)-propionic acid
- 3-[3,5-bis(chloranyl)phenyl]
- 3-(3,5-Dichlorophenyl)propanoic acid
-
- Inchi： 1S/C9H8Cl2O2/c10-7-3-6(1-2-9(12)13)4-8(11)5-7/h3-5H,1-2H2,(H,12,13)
- InChI Key： GQICJNXGCGRFBA-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=C(C=1)CCC(=O)O)Cl
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 175
- XLogP3: 2.9
- Topological Polar Surface Area: 37.3
3-(3,5-Dichlorophenyl)propanoic acid Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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