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Home > Nitro Compounds > 73721-78-5
73721-78-5 | 2-Acetamido-6-nitrobenzoic acid
CAS No: 73721-78-5 Catalog No: AG003EYO MDL No:MFCD08276267
Product Description
Catalog Number:
AG003EYO
Chemical Name:
2-Acetamido-6-nitrobenzoic acid
CAS Number:
73721-78-5
Molecular Formula:
C9H8N2O5
Molecular Weight:
224.1702
MDL Number:
MFCD08276267
IUPAC Name:
2-acetamido-6-nitrobenzoic acid
InChI:
InChI=1S/C9H8N2O5/c1-5(12)10-6-3-2-4-7(11(15)16)8(6)9(13)14/h2-4H,1H3,(H,10,12)(H,13,14)
InChI Key:
HHNTZMHFBQIQAK-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cccc(c1C(=O)O)[N+](=O)[O-]
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.043g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.172g/mol
Monoisotopic Mass:
224.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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