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56658-04-9 | 2-BROMO-5-METHOXYBENZOYL CHLORIDE
CAS No: 56658-04-9 Catalog No: AG003GPZ MDL No:MFCD00219937
Product Description
Catalog Number:
AG003GPZ
Chemical Name:
2-BROMO-5-METHOXYBENZOYL CHLORIDE
CAS Number:
56658-04-9
Molecular Formula:
C8H6BrClO2
Molecular Weight:
249.4890
MDL Number:
MFCD00219937
IUPAC Name:
2-bromo-5-methoxybenzoyl chloride
InChI:
InChI=1S/C8H6BrClO2/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3
InChI Key:
RZCQJXVXRYIJQE-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)Cl)Br
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.924g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.488g/mol
Monoisotopic Mass:
247.924g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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