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Home > Nitro Compounds > 125174-01-8
125174-01-8 | Benzeneheptanoic acid, 4-nitro-z-oxo-
CAS No: 125174-01-8 Catalog No: AG00HI4R MDL No:
Product Description
Catalog Number:
AG00HI4R
Chemical Name:
Benzeneheptanoic acid, 4-nitro-z-oxo-
CAS Number:
125174-01-8
IUPAC Name:
7-(4-nitrophenyl)-7-oxoheptanoic acid
InChI:
InChI=1S/C13H15NO5/c15-12(4-2-1-3-5-13(16)17)10-6-8-11(9-7-10)14(18)19/h6-9H,1-5H2,(H,16,17)
InChI Key:
HYQZTEVOGIGHGO-UHFFFAOYSA-N
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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