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N- (4-Aminophenyl) propanamide

CAT: 0024-sc-329969Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-329969Size:500 mg
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CAS Number
59690-89-0

Chemical Information

N-(4-Aminophenyl)propanamide
CAS Number59690-89-0
PubChem CID314342
IUPAC NameN-(4-aminophenyl)propanamide
Molecular FormulaC9H12N2O
Molecular Weight164.20
XLogP0.9
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity151
SMILES
CCC(=O)NC1=CC=C(C=C1)N
InChI
InChI=1S/C9H12N2O/c1-2-9(12)11-8-5-3-7(10)4-6-8/h3-6H,2,10H2,1H3,(H,11,12)
InChIKey
MOUFEEIQCXUUMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-Aminophenyl)propanamide
CAS: 59690-89-0
CID: 314342
Formula: C9H12N2O
MW: 164.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight164.20
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass164.094963011
Monoisotopic Mass164.094963011
Topological Polar Surface Area55.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity151
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