Cinnamamide

CAT: 0926-FC64888-03Size: 500 gDry Ice: NoHazardous: No

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CAT#:0926-FC64888-03Size:500 g

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CAS Number

621-79-4

MDL Number

MFCD00008033

Smiles

C1=CC=C (C=C1) /C=C/C (=O) N

Molecular Formula

C9H9NO

Molecular Weight

147.17 g/mol

Controlled

Chemical Information

2-Propenamide, 3-phenyl-

cinnamamide has been reported in Aristolochia kaempferi, Reseda luteola, and other organisms with data available.

CAS Number	621-79-4
PubChem CID	12135
IUPAC Name	3-phenylprop-2-enamide
Molecular Formula	C9H9NO
Molecular Weight	147.17
XLogP	1.4
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	157

SMILES

C1=CC=C(C=C1)C=CC(=O)N

InChI

InChI=1S/C9H9NO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H2,10,11)

InChIKey

APEJMQOBVMLION-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 621-79-4

CID: 12135

Formula: C9H9NO

MW: 147.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	147.17
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	147.068413911
Monoisotopic Mass	147.068413911
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	157
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
YAA59947-01	Cinnamolide

Catalog	Name
T20050-01	Cinnamamide
467922-01	Trans-Cinnamamide
GTR19176179-01	(E) -Cinnamamide
C6535-500	(E)-Cinnamamide
444571-01	Cinnamamide discontinued
sc-261539A	4- (Trifluoromethyl) cinnamamide
GTR19260170-01	N-methyl cinnamamide