Cas no 52923-23-6 ((2R)-HYDROXY(3-CHLOROPHENYL)ACETICACID)
52923-23-6 structure
Product Name:(2R)-HYDROXY(3-CHLOROPHENYL)ACETICACID
CAS No:52923-23-6
MF:C8H7ClO3
MW:186.592381715775
CID:937693
PubChem ID:2733127
Update Time:2025-04-19
(2R)-HYDROXY(3-CHLOROPHENYL)ACETICACID Chemical and Physical Properties
Names and Identifiers
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- (2R)-HYDROXY(3-CHLOROPHENYL)ACETICACID
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- Inchi： 1S/C8H7ClO3/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)/t7-/m1/s1
- InChI Key： SAMVPMGKGGLIPF-SSDOTTSWSA-N
- SMILES： ClC1=CC=CC(=C1)[C@H](C(=O)O)O
Computed Properties
- Exact Mass: 186.0083718g/mol
- Monoisotopic Mass: 186.0083718g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 172
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 57.5?2
(2R)-HYDROXY(3-CHLOROPHENYL)ACETICACID Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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