Cas no 158169-17-6 (2-[(1R)-1-Hydroxyethyl]benzoic acid)
![2-[(1R)-1-Hydroxyethyl]benzoic acid structure](https://ossimg.kuujia.com/scimg/158500/158169-17-6x500.png)
158169-17-6 structure
Product Name:2-[(1R)-1-Hydroxyethyl]benzoic acid
CAS No:158169-17-6
MF:C9H10O3
MW:166.173902988434
CID:108036
PubChem ID:26344007
Update Time:2024-02-29
2-[(1R)-1-Hydroxyethyl]benzoic acid Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid,2-(1-hydroxyethyl)-, (R)- (9CI)
- 2-[(1R)-1-Hydroxyethyl]benzoic acid
- Benzoic acid, 2-(1-hydroxyethyl)-, (R)- (9CI)
-
- Inchi： 1S/C9H10O3/c1-6(10)7-4-2-3-5-8(7)9(11)12/h2-6,10H,1H3,(H,11,12)/t6-/m1/s1
- InChI Key： GPBOXVCIWMHAJH-ZCFIWIBFSA-N
- SMILES： O[C@H](C)C1C=CC=CC=1C(=O)O
Computed Properties
- Exact Mass: 166.063
- Monoisotopic Mass: 166.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 167
- 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: 1.6
- Topological Polar Surface Area: 57.5
2-[(1R)-1-Hydroxyethyl]benzoic acid Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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