3-Ethoxyphenethylamine

CAT: 0024-sc-283753ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-283753ASize:5 g

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CAS Number

76935-76-7

Chemical Information

2-(3-Ethoxyphenyl)ethan-1-amine

CAS Number	76935-76-7
PubChem CID	2758765
IUPAC Name	2-(3-ethoxyphenyl)ethanamine
Molecular Formula	C10H15NO
Molecular Weight	165.23
XLogP	1.6
Topological Polar Surface Area	35.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	116

SMILES

CCOC1=CC=CC(=C1)CCN

InChI

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

InChIKey

PBWUNLYMHNSAPQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 76935-76-7

CID: 2758765

Formula: C10H15NO

MW: 165.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	165.23
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	165.115364102
Monoisotopic Mass	165.115364102
Topological Polar Surface Area	35.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	116
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-283133A	2-Ethoxyphenethylamine
sc-284223	4-Ethoxyphenethylamine
sc-284223A	4-Ethoxyphenethylamine
sc-283133	2-Ethoxyphenethylamine
sc-260433	3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
sc-261129	3,3,3-Trifluoropropionitrile
sc-347307A	3,3,3-trifluoropropanamide
sc-474290	3,3,3-Trimethoxypropanenitrile
sc-261128	3,3,3-Trifluoropropionaldehyde
sc-261132	3,3,3-Trifluoropropylamine

Catalog	Name
PC6825	3,3,3-Trifluoropropyl 3,3,3-trifluoropropanoate
NU-456L	3',3',3'-cAAG
JMB17199-01	3,3,3-Trifluoropropanehydrazide
PC4452-01	3,3,3-Trifluoropropylmethyldimethoxysilane
PC4603-01	3,3,3-Trifluoropropylamine
OR1043029-01	3,3',3''-Nitrilotripropanamide
OR89892-01	3,3',3''-Nitrilotripropanenitrile
PC901625	3,3,3-Trifluoropropanamide
PC7820FJ-01	3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
PDC53711-01	3- (3,3,3-Trifluoropropoxy) piperidine