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148993-19-5 | Benzoic acid, 4-bromo-3-chloro-, hydrazide
CAS No: 148993-19-5 Catalog No: AG001LBT MDL No:MFCD00270096
Product Description
Catalog Number:
AG001LBT
Chemical Name:
Benzoic acid, 4-bromo-3-chloro-, hydrazide
CAS Number:
148993-19-5
Molecular Formula:
C7H6BrClN2O
Molecular Weight:
249.4923
MDL Number:
MFCD00270096
IUPAC Name:
4-bromo-3-chlorobenzohydrazide
InChI:
InChI=1S/C7H6BrClN2O/c8-5-2-1-4(3-6(5)9)7(12)11-10/h1-3H,10H2,(H,11,12)
InChI Key:
AVMUCZNGCWTULU-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(c(c1)Cl)Br
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.935g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.492g/mol
Monoisotopic Mass:
247.935g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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