Cas no 90047-52-2 (1,2-Benzenedimethanol, 3-methoxy-)
90047-52-2 structure
Product Name:1,2-Benzenedimethanol, 3-methoxy-
CAS No:90047-52-2
MF:C9H12O3
MW:168.189783096313
CID:795540
PubChem ID:14892485
Update Time:2025-04-19
1,2-Benzenedimethanol, 3-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenedimethanol, 3-methoxy-
- [2-(hydroxymethyl)-3-methoxyphenyl]methanol
- 3-methoxy-1,2-bis(hydroxymethyl)benzene
- (3-Methoxy-1,2-phenylene)dimethanol
- 3-methoxy-o-xylene-alpha,alpha'-diol
- WVZCTHYCDFIHAA-UHFFFAOYSA-N
- 90047-52-2
- 3-Methoxy-1,2-benzenedimethanol
- SCHEMBL1029593
- (2-hydroxymethyl-6-methoxy-phenyl)-methanol
- DTXSID10565039
-
- Inchi： 1S/C9H12O3/c1-12-9-4-2-3-7(5-10)8(9)6-11/h2-4,10-11H,5-6H2,1H3
- InChI Key： WVZCTHYCDFIHAA-UHFFFAOYSA-N
- SMILES： O(C)C1=CC=CC(CO)=C1CO
Computed Properties
- Exact Mass: 168.078644241g/mol
- Monoisotopic Mass: 168.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 127
- 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: 0.1
- Topological Polar Surface Area: 49.7?2
1,2-Benzenedimethanol, 3-methoxy- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
90047-52-2 (1,2-Benzenedimethanol, 3-methoxy-) Related Products
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