Cas no 760884-44-4 (1,2-Benzenediol, 4-(2-pyridinylmethyl)- (9CI))
760884-44-4 structure
Product Name:1,2-Benzenediol, 4-(2-pyridinylmethyl)- (9CI)
CAS No:760884-44-4
MF:C12H11NO2
MW:201.221243143082
CID:1016840
PubChem ID:20561025
Update Time:2025-04-20
1,2-Benzenediol, 4-(2-pyridinylmethyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenediol, 4-(2-pyridinylmethyl)- (9CI)
- 4-(pyridin-2-ylmethyl)benzene-1,2-diol
- 760884-44-4
- 1,2-benzenediol,4-(2-pyridinylmethyl)-
- SCHEMBL6222196
- 1,2-Benzenediol, 4-(2-pyridinylmethyl)-(9ci)
- DB-211066
-
- Inchi： 1S/C12H11NO2/c14-11-5-4-9(8-12(11)15)7-10-3-1-2-6-13-10/h1-6,8,14-15H,7H2
- InChI Key： DFMXRNVIQGHUJY-UHFFFAOYSA-N
- SMILES： OC1=C(C=CC(=C1)CC1C=CC=CN=1)O
Computed Properties
- Exact Mass: 201.078978594g/mol
- Monoisotopic Mass: 201.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 198
- 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: 2.1
- Topological Polar Surface Area: 53.4?2
1,2-Benzenediol, 4-(2-pyridinylmethyl)- (9CI) Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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