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161919-74-0 | Benzene, 1-(bromomethyl)-2,4-dimethoxy-
CAS No: 161919-74-0 Catalog No: AG001SIR MDL No:MFCD09745130
Product Description
Catalog Number:
AG001SIR
Chemical Name:
Benzene, 1-(bromomethyl)-2,4-dimethoxy-
CAS Number:
161919-74-0
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
MDL Number:
MFCD09745130
IUPAC Name:
1-(bromomethyl)-2,4-dimethoxybenzene
InChI:
InChI=1S/C9H11BrO2/c1-11-8-4-3-7(6-10)9(5-8)12-2/h3-5H,6H2,1-2H3
InChI Key:
WZCFNCRZGRZNRV-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1CBr
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.994g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.089g/mol
Monoisotopic Mass:
229.994g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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