2- (2,4-Dichlorophenoxy) ethanamine

CAT: 0127-OR1044271-02Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1044271-02Size:250 mg

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CAS Number

1199-28-6

MDL Number

MFCD05668095

Purity

95%

Smiles

NCCOC1=CC=C(Cl)C=C1Cl

Chemical Information

2-(2,4-Dichlorophenoxy)ethylamine

CAS Number	1199-28-6
PubChem CID	150897
IUPAC Name	2-(2,4-dichlorophenoxy)ethanamine
Molecular Formula	C8H9Cl2NO
Molecular Weight	206.07
XLogP	2.7
Topological Polar Surface Area	35.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	134

SMILES

C1=CC(=C(C=C1Cl)Cl)OCCN

InChI

InChI=1S/C8H9Cl2NO/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5H,3-4,11H2

InChIKey

NZWBXPGUWYWOOS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1199-28-6

CID: 150897

Formula: C8H9Cl2NO

MW: 206.07

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	206.07
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	205.0061193
Monoisotopic Mass	205.0061193
Topological Polar Surface Area	35.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	134
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
OR93335-01	2- (3,4-Dichlorophenoxy) ethanamine hydrochloride
OR78441-01	2- (3,5-Dichlorophenoxy) ethanamine hydrochloride
OR23818	2- (2,4-dichlorophenoxy) benzonitrile
OR12187	2- (2,4-Dichlorophenoxy) ethanethioamide
OR1099520	2- (2,4-dichlorophenoxy) aniline
OR29562-01	2- (2,4-dichlorophenoxy) acetonitrile
OR111487	2- (2,4-Dichlorophenoxy) nicotinonitrile
OR1097708-01	4- (2,4-Dichlorophenoxy) benzonitrile
OR1021065	2- (2,4-Dichlorophenoxy) ethanol
OR24032	4'- (2,4-Dichlorophenoxy) acetophenone

Catalog	Name
sc-273902	2- (4-methylphenoxy) ethanamine
sc-339946A	2- (4-isopropoxyphenyl) ethanamine
TRC-P318675-2.5G	2-(4-Phenoxyphenoxy)ethanamine
AL BW 1424-01	2- (4-benzylphenyl) ethanamine
AL BW 0417-01	2- (4-chlorophenoxy) ethanamine
JDA55803	2- (4-Isopropylphenyl) ethanamine
sc-339884	2- (4-ethoxyphenoxy) ethanamine
AL BW 0284-01	2- (2,4-difluorophenyl) ethanamine
RG-D091401-01	2- (2,4-Dinitrophenyl) Ethanamine
HAA72874-01	2- (Thiazol-4-yl) ethanamine