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Home > Nitro Compounds > 313241-45-1
313241-45-1 | N-(4-hydroxyphenyl)-3-nitrobenzamide
CAS No: 313241-45-1 Catalog No: AG019P2M MDL No:MFCD00227269
Product Description
Catalog Number:
AG019P2M
Chemical Name:
N-(4-hydroxyphenyl)-3-nitrobenzamide
CAS Number:
313241-45-1
Molecular Formula:
C13H10N2O4
Molecular Weight:
258.2295
MDL Number:
MFCD00227269
IUPAC Name:
N-(4-hydroxyphenyl)-3-nitrobenzamide
InChI:
InChI=1S/C13H10N2O4/c16-12-6-4-10(5-7-12)14-13(17)9-2-1-3-11(8-9)15(18)19/h1-8,16H,(H,14,17)
InChI Key:
QRMFVSAMUVRYHP-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)NC(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.064g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.233g/mol
Monoisotopic Mass:
258.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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