Ethyl (1-phenylpropyl) amine

CAT: 0926-MDA87692-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-MDA87692-01Size:0.5 g

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CAS Number

87876-92-4

MDL Number

MFCD09951075

Smiles

CCC (C1=CC=CC=C1) NCC

Molecular Formula

C11H17N

Molecular Weight

163.26 g/mol

Controlled

Chemical Information

Ethyl(1-phenylpropyl)amine

CAS Number	87876-92-4
PubChem CID	13115192
IUPAC Name	N-ethyl-1-phenylpropan-1-amine
Molecular Formula	C11H17N
Molecular Weight	163.26
XLogP	2.6
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	106

SMILES

CCC(C1=CC=CC=C1)NCC

InChI

InChI=1S/C11H17N/c1-3-11(12-4-2)10-8-6-5-7-9-10/h5-9,11-12H,3-4H2,1-2H3

InChIKey

IFIZHIAVDJBZBY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 87876-92-4

CID: 13115192

Formula: C11H17N

MW: 163.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	163.26
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	163.136099547
Monoisotopic Mass	163.136099547
Topological Polar Surface Area	12 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	106
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BEA50701-01	[2- (Dimethylamino) ethyl] (3-phenylpropyl) amine
SDA11108-01	Butyl (1-phenylpropyl) amine
ZFA52957-01	(1-Phenylpropyl) (propyl) amine
UQB59643-01	(1-Phenylpropyl) (propan-2-yl) amine
LCC31522-01	(2-Methylpropyl) (1-phenylpropyl) amine hydrochloride
GCA12956-01	Methyl (2-methyl-1-phenylpropyl) amine
DXB33516-01	(2,2-Dimethoxyethyl) (1-phenylpropyl) amine
DFA89992-01	(2-Amino-3-phenylpropyl) (methyl) amine
SCA88481-01	(3-Aminopropyl) (3-phenylpropyl) amine
YHA89619-01	1- (3-Phenylpropyl) piperidin-4-amine dihydrochloride

Catalog	Name
sc-351786A	Ethyl[1- (4-fluorophenyl) ethyl]amine hydrochloride
sc-326711	Cyclopentyl- (1-phenyl-ethyl) -amine
sc-282418	[2- (1-adamantylthio) ethyl]amine
sc-342696A	2-ethyl-1-phenylbutan-1-amine
285464-01	S- (-) -1- (1-Naphthyl) ethyl amine
sc-303466	(1-Ethyl-piperidin-4-yl) - (1-phenyl-ethyl) -amine
TRC-M266385-1G	(-)-[(S)-1-(4-Methoxyphenyl)ethyl]amine
sc-354072	Methyl[1- (2-methylphenyl) ethyl]amine
sc-332238A	[1- (2-fluorophenyl) ethyl] (methyl) amine
sc-333958A	1-ethyl-N-methylpiperidin-4-amine