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895242-33-8 | 1,1'-Biphenyl,3'-(bromomethyl)-3,4-dimethoxy-
CAS No: 895242-33-8 Catalog No: AG003ZSI MDL No:
Product Description
Catalog Number:
AG003ZSI
Chemical Name:
1,1'-Biphenyl,3'-(bromomethyl)-3,4-dimethoxy-
CAS Number:
895242-33-8
Molecular Formula:
C15H15BrO2
Molecular Weight:
307.1824
IUPAC Name:
4-[3-(bromomethyl)phenyl]-1,2-dimethoxybenzene
InChI:
InChI=1S/C15H15BrO2/c1-17-14-7-6-13(9-15(14)18-2)12-5-3-4-11(8-12)10-16/h3-9H,10H2,1-2H3
InChI Key:
OYIMZUQEXLAKSK-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1cccc(c1)CBr
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.026g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.187g/mol
Monoisotopic Mass:
306.026g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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