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877149-13-8 | Benzamide,4-bromo-2-chloro-6-methyl-
CAS No: 877149-13-8 Catalog No: AG004JCL MDL No:
Product Description
Catalog Number:
AG004JCL
Chemical Name:
Benzamide,4-bromo-2-chloro-6-methyl-
CAS Number:
877149-13-8
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
IUPAC Name:
4-bromo-2-chloro-6-methylbenzamide
InChI:
InChI=1S/C8H7BrClNO/c1-4-2-5(9)3-6(10)7(4)8(11)12/h2-3H,1H3,(H2,11,12)
InChI Key:
UBQOWAZMOIWUIJ-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c(c(c1)Cl)C(=O)N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.504g/mol
Monoisotopic Mass:
246.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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