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Home > Nitro Compounds > 88229-25-8
88229-25-8 | Benzamide, 2-nitro-N-2-propenyl-
CAS No: 88229-25-8 Catalog No: AG004B7I MDL No:
Product Description
Catalog Number:
AG004B7I
Chemical Name:
Benzamide, 2-nitro-N-2-propenyl-
CAS Number:
88229-25-8
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
IUPAC Name:
2-nitro-N-prop-2-enylbenzamide
InChI:
InChI=1S/C10H10N2O3/c1-2-7-11-10(13)8-5-3-4-6-9(8)12(14)15/h2-6H,1,7H2,(H,11,13)
InChI Key:
VXQOIWKQOUDDHZ-UHFFFAOYSA-N
SMILES:
C=CCNC(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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