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Home > Nitro Compounds > 66147-99-7
66147-99-7 | 7-(4-Nitrophenyl)heptanoic acid
CAS No: 66147-99-7 Catalog No: AG01EF9J MDL No:
Product Description
Catalog Number:
AG01EF9J
Chemical Name:
7-(4-Nitrophenyl)heptanoic acid
CAS Number:
66147-99-7
IUPAC Name:
7-(4-nitrophenyl)heptanoic acid
InChI:
InChI=1S/C13H17NO4/c15-13(16)6-4-2-1-3-5-11-7-9-12(10-8-11)14(17)18/h7-10H,1-6H2,(H,15,16)
InChI Key:
DKGPAKSYZIIBBX-UHFFFAOYSA-N
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.282g/mol
Monoisotopic Mass:
251.116g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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