2,3,4-Trimethoxybenzyl alcohol - CAS 71989-96-3

Catalog:	BB034510
Product Name:	2,3,4-Trimethoxybenzyl alcohol
CAS:	71989-96-3
Synonyms:	(2,3,4-trimethoxyphenyl)methanol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(2,3,4-trimethoxyphenyl)methanol
Description:	An impurity of Trimetazidine. Trimetazidine is a drug for angina pectoris.
Molecular Weight:	198.22
Molecular Formula:	C10H14O4
Canonical SMILES:	COC1=C(C(=C(C=C1)CO)OC)OC
InChI:	InChI=1S/C10H14O4/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-5,11H,6H2,1-3H3
InChI Key:	DGJVVEVPKPOLEV-UHFFFAOYSA-N
Boiling Point:	105 ℃ / 25 mmHg (lit.)
Density:	1.151 g/mL at 25℃(lit.)
Appearance:	Clear colourless oil
MDL:	MFCD00004613
LogP:	1.20470

Publication Number	Title	Priority Date
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021112933-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
EP-3322687-A1	2-benzyl-indanone compounds as anticancer agent and a process for preparation thereof	20150713
EP-3322687-B1	2-benzyl-indanone compounds as anticancer agent and a process for preparation thereof	20150713
WO-2017009860-A1	2-benzyl-indanone compounds as anticancer agent and a process for preparation thereof	20150713

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Related Functional Groups

Oxygen Compounds

[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[5333-45-9]
1,2,3,5-Tetramethoxybenzene
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[5416-55-7]
2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol
[56517-33-0]
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	198.08920892
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	198.08920892
Rotatable Bond Count:	4
Topological Polar Surface Area:	47.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9