Cas no 31366-97-9 ([1,1'-Biphenyl]-4-ol,3-chloro-, sodium salt (1:1))
31366-97-9 structure
Product Name:[1,1'-Biphenyl]-4-ol,3-chloro-, sodium salt (1:1)
CAS No:31366-97-9
MF:C12H8ClNaO
MW:226.634093284607
CID:314812
PubChem ID:23705733
Update Time:2025-04-19
[1,1'-Biphenyl]-4-ol,3-chloro-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-4-ol,3-chloro-, sodium salt (1:1)
- SODIUM 2-CHLORO-4-PHENYLPHENATE
- sodium,2-chloro-4-phenylphenolate
- Sodium 2-chloro-4-phenylphenolate
- 3HNV61OUA1
- 4-Biphenylol, 3-chloro-, sodium salt
- (1,1'-Biphenyl)-4-ol, 3-chloro-, sodium salt
- 31366-97-9
- SCHEMBL5933701
- Q27257223
- Phenol, 2-chloro-4-phenyl-, sodium deriv.
- UNII-3HNV61OUA1
- 2-Chloro-4-phenylphenol sodium salt
-
- Inchi: 1S/C12H9ClO.Na/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9;/h1-8,14H;/q;+1/p-1
- InChI Key: ARCOPJIXLBWKLT-UHFFFAOYSA-M
- SMILES: ClC1=C(C=CC(=C1)C1C=CC=CC=1)[O-].[Na+]
Computed Properties
- Exact Mass: 226.01624
- Monoisotopic Mass: 226.016137
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 183
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 23.1
Experimental Properties
- Boiling Point: 317.4°C at 760 mmHg
- Flash Point: 145.8°C
- PSA: 23.06
[1,1'-Biphenyl]-4-ol,3-chloro-, sodium salt (1:1) Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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