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Home > Nitro Compounds > 73859-73-1
73859-73-1 | 1-(4-NITROBENZOYL)SEMICARBAZIDE
CAS No: 73859-73-1 Catalog No: AG005AYH MDL No:
Product Description
Catalog Number:
AG005AYH
Chemical Name:
1-(4-NITROBENZOYL)SEMICARBAZIDE
CAS Number:
73859-73-1
Molecular Formula:
C8H8N4O4
Molecular Weight:
224.1735
IUPAC Name:
[(4-nitrobenzoyl)amino]urea
InChI:
InChI=1S/C8H8N4O4/c9-8(14)11-10-7(13)5-1-3-6(4-2-5)12(15)16/h1-4H,(H,10,13)(H3,9,11,14)
InChI Key:
PKZCWOZBUIFLBT-UHFFFAOYSA-N
SMILES:
NC(=O)NNC(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.055g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
224.176g/mol
Monoisotopic Mass:
224.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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