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1263376-88-0 | 5-Bromo-2-chloro-3-methylbenzoyl chloride
CAS No: 1263376-88-0 Catalog No: AG01FBJP MDL No:MFCD18379820
Product Description
Catalog Number:
AG01FBJP
Chemical Name:
5-Bromo-2-chloro-3-methylbenzoyl chloride
CAS Number:
1263376-88-0
Molecular Formula:
C8H5BrCl2O
Molecular Weight:
267.9347
MDL Number:
MFCD18379820
IUPAC Name:
5-bromo-2-chloro-3-methylbenzoyl chloride
InChI:
InChI=1S/C8H5BrCl2O/c1-4-2-5(9)3-6(7(4)10)8(11)12/h2-3H,1H3
InChI Key:
KEXFUVHQRNSLPK-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c(c(c1)C(=O)Cl)Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.89g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.931g/mol
Monoisotopic Mass:
265.89g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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