Cas no 74726-76-4 (Benzenemethanol, 2-bromo-3,5-dimethoxy-)
74726-76-4 structure
Product Name:Benzenemethanol, 2-bromo-3,5-dimethoxy-
CAS No:74726-76-4
MF:C9H11BrO3
MW:247.085842370987
CID:530790
PubChem ID:10927076
Update Time:2025-04-19
Benzenemethanol, 2-bromo-3,5-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 2-bromo-3,5-dimethoxy-
- (2-bromo-3,5-dimethoxyphenyl)methanol
- 2-Brom-3,5-dimethoxy-benzylalkohol
- CS-0529039
- DTXSID70448612
- SCHEMBL12404016
- 74726-76-4
-
- Inchi: 1S/C9H11BrO3/c1-12-7-3-6(5-11)9(10)8(4-7)13-2/h3-4,11H,5H2,1-2H3
- InChI Key: YIPREDUTBGZRQG-UHFFFAOYSA-N
- SMILES: BrC1C(=CC(=CC=1CO)OC)OC
Computed Properties
- Exact Mass: 245.98916g/mol
- Monoisotopic Mass: 245.98916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 154
- 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: 1.7
- Topological Polar Surface Area: 38.7?2
Benzenemethanol, 2-bromo-3,5-dimethoxy- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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