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Home > Nitro Compounds > 5933-35-7
5933-35-7 | 2-(2-Nitroanilino)benzoic acid
CAS No: 5933-35-7 Catalog No: AG00EZVW MDL No:
Product Description
Catalog Number:
AG00EZVW
Chemical Name:
2-(2-Nitroanilino)benzoic acid
CAS Number:
5933-35-7
IUPAC Name:
2-(2-nitroanilino)benzoic acid
InChI:
InChI=1S/C13H10N2O4/c16-13(17)9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15(18)19/h1-8,14H,(H,16,17)
InChI Key:
FJNZXTAFUISVCI-UHFFFAOYSA-N
NSC Number:
406464
Properties
Complexity:
342
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:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.233g/mol
Monoisotopic Mass:
258.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| 2-(2-Nitro-anilino)benzoic acid. | Acta crystallographica. Section E, Structure reports online 20120101 |
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