Cas no 115706-50-8 ([1,1'-Biphenyl]-2-carbonitrile,3,5-dihydroxy-)
115706-50-8 structure
Product Name:[1,1'-Biphenyl]-2-carbonitrile,3,5-dihydroxy-
CAS No:115706-50-8
MF:C13H9NO2
MW:211.216063261032
CID:132543
PubChem ID:14165405
Update Time:2025-04-19
[1,1'-Biphenyl]-2-carbonitrile,3,5-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-2-carbonitrile,3,5-dihydroxy-
- [1,1-Biphenyl]-2-carbonitrile,3,5-dihydroxy-(9CI)
- 2,4-dihydroxy-6-phenylbenzonitrile
- 115706-50-8
- [1,1-biphenyl]-2-carbonitrile,3,5-dihydroxy-
-
- Inchi: 1S/C13H9NO2/c14-8-12-11(6-10(15)7-13(12)16)9-4-2-1-3-5-9/h1-7,15-16H
- InChI Key: XCRZHXRLRCVYKL-UHFFFAOYSA-N
- SMILES: OC1=CC(=CC(=C1C#N)C1C=CC=CC=1)O
Computed Properties
- Exact Mass: 211.06337
- Monoisotopic Mass: 211.063328530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 277
- 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: 3.1
- Topological Polar Surface Area: 64.2?2
Experimental Properties
- PSA: 64.25
[1,1'-Biphenyl]-2-carbonitrile,3,5-dihydroxy- Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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