2,3-Dimethoxyphenethylamine

CAT: 1596-AR-B06366-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-B06366-02Size:25 Units

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CAS Number

3213-29-4

Synonyms

2- (2,3-Dimethoxyphenyl) ethan-1-amine

Molecular Formula

C10H15NO2

Molecular Weight

181.24

API Name

Benzene

Chemical Information

2,3-Dimethoxyphenethylamine

CAS Number	3213-29-4
PubChem CID	137858
IUPAC Name	2-(2,3-dimethoxyphenyl)ethanamine
Molecular Formula	C10H15NO2
Molecular Weight	181.23
XLogP	1.2
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	141

SMILES

COC1=CC=CC(=C1OC)CCN

InChI

InChI=1S/C10H15NO2/c1-12-9-5-3-4-8(6-7-11)10(9)13-2/h3-5H,6-7,11H2,1-2H3

InChIKey

XKBUFTXNLBWTFP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3213-29-4

CID: 137858

Formula: C10H15NO2

MW: 181.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.23
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	181.110278721
Monoisotopic Mass	181.110278721
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	141
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

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Catalog	Name
sc-230838	2,3-Dimethoxyphenethylamine
MBS5786240	3,4-Dimethoxyphenethylamine
39791435	3,4-Dimethoxyphenethylamine (Homoveratrylamine)
MBS6100562-01	2,5-Dimethoxyphenethylamine
FC76171-01	2-Chloro-3,4-dimethoxyphenethylamine HCl
BNB44277-01	2,5-Dimethoxyphenethylamine-d6
010170	2,5-Dimethoxyphenethylamine discontinued
TRC-D460841-10MG	2,5-Dimethoxyphenethylamine Hydrochloride
sc-497579	4-Ethyl-2,5-dimethoxyphenethylamine Hydrochloride
280343-01	4-Iodo-2,5-dimethoxyphenethylamine HCI