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16932-45-9 | 2-Bromo-1,3-dimethoxybenzene
CAS No: 16932-45-9 Catalog No: AG003B15 MDL No:MFCD07780177
Product Description
Catalog Number:
AG003B15
Chemical Name:
2-Bromo-1,3-dimethoxybenzene
CAS Number:
16932-45-9
Molecular Formula:
C8H9BrO2
Molecular Weight:
217.0599
MDL Number:
MFCD07780177
IUPAC Name:
2-bromo-1,3-dimethoxybenzene
InChI:
InChI=1S/C8H9BrO2/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5H,1-2H3
InChI Key:
VHVYSMMZHORFKU-UHFFFAOYSA-N
SMILES:
COc1cccc(c1Br)OC
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.062g/mol
Monoisotopic Mass:
215.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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