N-Phenylpropanamide-d3

CAT: 0024-sc-478869Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-478869Size:10 mg

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CAS Number

1346598-63-7

Chemical Information

N-Phenylpropanamide-d3

CAS Number	1346598-63-7
PubChem CID	71772190
IUPAC Name	2,2,3-trideuterio-N-phenylpropanamide
Molecular Formula	C9H11NO
Molecular Weight	152.21
XLogP	1.6
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	128

SMILES

[2H]CC([2H])([2H])C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C9H11NO/c1-2-9(11)10-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,10,11)/i1D,2D2

InChIKey

ZTHRQJQJODGZHV-APAIHEESSA-N

Chemical Structure

2D Structure

CAS: 1346598-63-7

CID: 71772190

Formula: C9H11NO

MW: 152.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.21
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	152.102894212
Monoisotopic Mass	152.102894212
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	128
Isotope Atom Count	3
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-460249	N-Phenylpropanamide
sc-478402	N-Phenylpropanamide-d5
sc-283101	2-chloro-N-phenylpropanamide
sc-342523A	2-chloro-N-ethyl-N-phenylpropanamide
sc-342523	2-chloro-N-ethyl-N-phenylpropanamide
sc-329940	N- (4-Aminophenyl) -3-phenylpropanamide
sc-329538	N- (3-Aminophenyl) -3-phenylpropanamide
sc-347250	3-phenylpropanamide
sc-341881	2-chloro-N- (2-cyanoethyl) -N-phenylpropanamide
sc-341395	2-amino-N, N-diethyl-3-phenylpropanamide

Catalog	Name
019577	N-Phenylpropanamide-d3
CS-T-39672	N-Phenylpropanamide
165458	N-Phenylpropanamide-d5
RG-B181573-01	2-Bromo-N-Phenylpropanamide
OR964996-01	3-Chloro-N-phenylpropanamide
KAA26423-01	N-Cyclohexyl-3-phenylpropanamide
HCA52864-01	3-Amino-N-phenylpropanamide
AR-A06584-01	2-Chloro-N-Phenylpropanamide
TRC-E918445-50MG	N-Ethyl-3-phenylpropanamide
OR1027852-01	3-Bromo-N-Phenylpropanamide