Cas no 89929-88-4 (Benzenemethanol, 2-methyl-3-(2-thienyl)-)
89929-88-4 structure
Product Name:Benzenemethanol, 2-methyl-3-(2-thienyl)-
CAS No:89929-88-4
MF:C12H12OS
MW:204.288082122803
CID:585084
PubChem ID:13243418
Update Time:2025-04-19
Benzenemethanol, 2-methyl-3-(2-thienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 2-methyl-3-(2-thienyl)-
- (2-methyl-3-thiophen-2-ylphenyl)methanol
- 89929-88-4
- [2-Methyl-3-(thiophen-2-yl)phenyl]methanol
- DTXSID90531434
- FGERJWDKKXDBAW-UHFFFAOYSA-N
- SCHEMBL11065500
- 2-methyl-3-(2-thienyl)phenylmethanol
-
- Inchi： 1S/C12H12OS/c1-9-10(8-13)4-2-5-11(9)12-6-3-7-14-12/h2-7,13H,8H2,1H3
- InChI Key： FGERJWDKKXDBAW-UHFFFAOYSA-N
- SMILES： S1C=CC=C1C1C=CC=C(CO)C=1C
Computed Properties
- Exact Mass: 204.06088618g/mol
- Monoisotopic Mass: 204.06088618g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 183
- 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: 2.7
- Topological Polar Surface Area: 48.5?2
Benzenemethanol, 2-methyl-3-(2-thienyl)- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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