(3-chlorophenyl) ethylamine

CAT: 0024-sc-289111Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-289111Size:100 mg

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CAS Number

15258-44-3

Chemical Information

3-chloro-N-ethylaniline

CAS Number	15258-44-3
PubChem CID	12268242
IUPAC Name	3-chloro-N-ethylaniline
Molecular Formula	C8H10ClN
Molecular Weight	155.62
XLogP	2.9
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	95

SMILES

CCNC1=CC(=CC=C1)Cl

InChI

InChI=1S/C8H10ClN/c1-2-10-8-5-3-4-7(9)6-8/h3-6,10H,2H2,1H3

InChIKey

LUNFYXBUYWMPBY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15258-44-3

CID: 12268242

Formula: C8H10ClN

MW: 155.62

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	155.62
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	155.0501770
Monoisotopic Mass	155.0501770
Topological Polar Surface Area	12 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95.3
Isotope Atom Count	0
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-254036	2- (2-Chlorophenyl) ethylamine
sc-254053	2- (4-Chlorophenyl) ethylamine
sc-222556	1- (4-Chlorophenyl) ethylamine
sc-265232	2- (4-Chlorophenyl) ethylamine HCl
sc-288142A	2-Hydroxy-2- (2-chlorophenyl) ethylamine hydrochloride
sc-288142	2-Hydroxy-2- (2-chlorophenyl) ethylamine hydrochloride
sc-281792	1- (3-chlorophenyl) ethanamine
sc-344414	3- (4-chlorophenyl) -3- (ethylamino) acrylonitrile
sc-344414A	3- (4-chlorophenyl) -3- (ethylamino) acrylonitrile
sc-334424	(1S) -1- (3-chlorophenyl) ethanamine