(2,3-Dimethoxyphenyl) methanol

CAT: 0013-GTR19280813-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19280813-01Size:10 mg

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Description

(2,3-Dimethoxyphenyl) methanol is an impurity found in pharmaceuticals.

CAS Number

5653-67-8

Smiles

OCC=1C=CC=C (OC) C1OC

Molecular Formula

C9H12O3

Molecular Weight

168.19

Notes

For research use only.

Chemical Information

2,3-Dimethoxybenzyl alcohol

CAS Number	5653-67-8
PubChem CID	79738
IUPAC Name	(2,3-dimethoxyphenyl)methanol
Molecular Formula	C9H12O3
Molecular Weight	168.19
XLogP	1
Topological Polar Surface Area	38.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	127

SMILES

COC1=CC=CC(=C1OC)CO

InChI

InChI=1S/C9H12O3/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-5,10H,6H2,1-2H3

InChIKey

CRLBBOBKCLYCJK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5653-67-8

CID: 79738

Formula: C9H12O3

MW: 168.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	168.19
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	168.078644241
Monoisotopic Mass	168.078644241
Topological Polar Surface Area	38.7 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
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GTR19252629-01	[3- (2-Furyl) phenyl]methanol
GTR19252343-01	(2-Piperidino-3-pyridinyl) methanol
GTR19257299-01	(3-FLUOROPYRID-2-YL) METHANOL
GTR19251802-01	(2-Methyl-3-furyl) methanol
GTR19268084-01	(3-Methyloxiran-2-yl) methanol
GTR19271915-01	3- (3,4-dimethoxyphenyl) -1- (2-hydroxy-4,6-dimethoxyphenyl) propan-1-one
GTR19259062-01	1,2,3,4-Tetrahydroisoquinoline-3-Methanol
GTR19253401-01	[2- (1-Pyrrolidinyl) -3-pyridinyl]methanol

Catalog	Name
HY-Z0549-01	(2,3-Dimethoxyphenyl) methanol
HY-Z0549R-01	(2,3-Dimethoxyphenyl) methanol (Standard)
OR1058391-01	(2-Bromo-3,5-dimethoxyphenyl) methanol
sc-335380	(2,3-Dimethoxyphenyl) (4-pyridinyl) methanol
PC1010860-01	(2-Fluoro-3,6-dimethoxyphenyl) methanol
TDA98313	(2-chloro-3,4-dimethoxyphenyl) methanol
PC1012727	(3-Fluoro-2,6-dimethoxyphenyl) methanol
OR1080329	(6-bromo-2,3-dimethoxyphenyl) methanol
OR1084795-01	(3-Chloro-2,4-dimethoxyphenyl) methanol
OR1094389	(5-Bromo-2,3-dimethoxyphenyl) methanol