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84225-91-2 | Benzoyl chloride, 3-bromo-2,6-dimethoxy-
CAS No: 84225-91-2 Catalog No: AG004RJO MDL No:
Product Description
Catalog Number:
AG004RJO
Chemical Name:
Benzoyl chloride, 3-bromo-2,6-dimethoxy-
CAS Number:
84225-91-2
Molecular Formula:
C9H8BrClO3
Molecular Weight:
279.5150
IUPAC Name:
3-bromo-2,6-dimethoxybenzoyl chloride
InChI:
InChI=1S/C9H8BrClO3/c1-13-6-4-3-5(10)8(14-2)7(6)9(11)12/h3-4H,1-2H3
InChI Key:
CHIRKTGXHJSREC-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1C(=O)Cl)OC)Br
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.935g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.514g/mol
Monoisotopic Mass:
277.935g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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