2- (3,4-Dimethylphenoxy) ethanamine

CAT: 0127-OR322128Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

26646-48-0

MDL Number

MFCD02366617

Purity

=95%

Smiles

Cc1ccc(OCCN)cc1C

Chemical Information

2-(3,4-Dimethylphenoxy)ethanamine

CAS Number	26646-48-0
PubChem CID	1991422
IUPAC Name	2-(3,4-dimethylphenoxy)ethanamine
Molecular Formula	C10H15NO
Molecular Weight	165.23
XLogP	2.2
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	127

SMILES

CC1=C(C=C(C=C1)OCCN)C

InChI

InChI=1S/C10H15NO/c1-8-3-4-10(7-9(8)2)12-6-5-11/h3-4,7H,5-6,11H2,1-2H3

InChIKey

ABZJNEBQBOTWLB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 26646-48-0

CID: 1991422

Formula: C10H15NO

MW: 165.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	165.23
XLogP3	2.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	165.115364102
Monoisotopic Mass	165.115364102
Topological Polar Surface Area	35.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	127
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
OR110498	2- (3,4-Dimethylphenoxy) benzaldehyde
OR1004534	2- (3,4-Dimethylphenoxy) butanamide
OR1032466-01	4- (2,3-Dimethylphenoxy) piperidine hydrochloride
OR110505-01	[2- (3,4-Dimethylphenoxy) phenyl]methanol
OR1069426-01	4- (3,4-Dimethylphenoxy) aniline
OR9293-01	2- (2,4-Dimethylphenoxy) acetohydrazide
OR1003590-01	2- (2,4-Dimethylphenoxy) acetamide
OR1098187-01	2- (2,4-dimethylphenoxy) -Acetonitrile
OR1003584-01	2- (4-Chloro-3,5-dimethylphenoxy) ethanol
OR111625	(2,4-Dichloro-3,5-dimethylphenoxy) acetonitrile

Catalog	Name
sc-330673	N-[2- (3,4-Dimethylphenoxy) ethyl]-1-phenyl-1-ethanamine
sc-305503	2- (4-Chloro-3,5-dimethylphenoxy) -N-ethyl-1-ethanamine
sc-305504	2- (4-Chloro-3,5-dimethylphenoxy) -N-methyl-1-ethanamine
sc-334814	2- (2,6-dimethylphenoxy) ethanamine hydrochloride
sc-329038	N- (2-Chlorobenzyl) -2- (2,4-dimethylphenoxy) -1-ethanamine
sc-330679	N-[2- (3,5-Dimethylphenoxy) ethyl]-1-phenyl-1-ethanamine
sc-331181	N-Benzyl-2- (2,6-dimethylphenoxy) -1-ethanamine
TRC-B593708-1G	2-(3,4-Diethoxyphenyl)ethanamine
sc-281827	1- (3,4-dimethylphenyl) ethanamine
FD97834-01	2- (3,4-Difluorophenyl) ethanamine