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7335-77-5 | 2-Benzoyl-6-nitrobenzoic acid
CAS No: 7335-77-5 Catalog No: AG00FJZ1 MDL No:
Product Description
Catalog Number:
AG00FJZ1
Chemical Name:
2-Benzoyl-6-nitrobenzoic acid
CAS Number:
7335-77-5
IUPAC Name:
2-benzoyl-6-nitrobenzoic acid
InChI:
InChI=1S/C14H9NO5/c16-13(9-5-2-1-3-6-9)10-7-4-8-11(15(19)20)12(10)14(17)18/h1-8H,(H,17,18)
InChI Key:
WRXSPQXXLMCAGM-UHFFFAOYSA-N
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.048g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.228g/mol
Monoisotopic Mass:
271.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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