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Home > Nitro Compounds > 1403483-54-4
1403483-54-4 | 3-(4-Formyl-3-nitrophenyl)benzoic acid
CAS No: 1403483-54-4 Catalog No: AG00HVSV MDL No:
Product Description
Catalog Number:
AG00HVSV
Chemical Name:
3-(4-Formyl-3-nitrophenyl)benzoic acid
CAS Number:
1403483-54-4
IUPAC Name:
3-(4-formyl-3-nitrophenyl)benzoic acid
InChI:
InChI=1S/C14H9NO5/c16-8-12-5-4-10(7-13(12)15(19)20)9-2-1-3-11(6-9)14(17)18/h1-8H,(H,17,18)
InChI Key:
TVAUSLSSORMHJM-UHFFFAOYSA-N
Properties
Complexity:
392
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:
2.4
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