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2- (Phenylformamido) prop-2-enamide

CAT: 1299-RG-E140434-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-E140434-01Size:10 mg
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CAS Number
478932-11-5
Synonyms
N- (3-amino-3-oxoprop-1-en-2-yl) benzamide
Molecular Formula
C10H10N2O2
Molecular Weight
190.2
Product Name Synonym
N- (3-amino-3-oxoprop-1-en-2-yl) benzamide

Chemical Information

N-(3-amino-3-oxoprop-1-en-2-yl)benzamide
CAS Number478932-11-5
PubChem CID569995
IUPAC NameN-(3-amino-3-oxoprop-1-en-2-yl)benzamide
Molecular FormulaC10H10N2O2
Molecular Weight190.20
XLogP0.8
Topological Polar Surface Area72.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count14
Formal Charge0
Complexity255
SMILES
C=C(C(=O)N)NC(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H10N2O2/c1-7(9(11)13)12-10(14)8-5-3-2-4-6-8/h2-6H,1H2,(H2,11,13)(H,12,14)
InChIKey
CZVJSDGIWSVXMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3-amino-3-oxoprop-1-en-2-yl)benzamide
CAS: 478932-11-5
CID: 569995
Formula: C10H10N2O2
MW: 190.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight190.20
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass190.074227566
Monoisotopic Mass190.074227566
Topological Polar Surface Area72.2 Ų
Heavy Atom Count14
Formal Charge0
Complexity255
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes