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Home > Encyclopedia > 3,4,5-Trimethoxyphenylacetic acid

3,4,5-Trimethoxyphenylacetic acid

3,4,5-Trimethoxyphenylacetic acid structure

3,4,5-Trimethoxyphenylacetic acid 

structure
  • CAS No:

    951-82-6

  • Formula:

    C11H14O5

  • Chemical Name:

    3,4,5-Trimethoxyphenylacetic acid

  • Synonyms:

    Benzeneacetic acid,3,4,5-trimethoxy-;Acetic acid,(3,4,5-trimethoxyphenyl)-;3,4,5-Trimethoxybenzeneacetic acid;3,4,5-Trimethoxyphenylacetic acid;NSC 130961;NSC 91017;2-(3,4,5-Trimethoxyphenyl)acetic acid

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

white to cream-colored crystalline powder


2-(3,4,5-trimethoxyphenyl)acetic acid is a member of methoxybenzenes.

3,4,5-Trimethoxyphenylacetic acid Basic Attributes

226.23

226.23

213-456-2

K1HZ43C68Y

130961

DTXSID60241755

2918990090

Characteristics

65

0.9

1.2±0.1 g/cm3

74 °C

138.1±20.0 °C

1.520

SOLUBLE

Safety Information

NONH for all modes of transport

3

R38

S22-S24/25

Xi:Irritant;

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

3,4,5-trimethoxyphenylacetic acid

Computed Properties

Molecular Weight:226.23
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:226.08412354
Monoisotopic Mass:226.08412354
Topological Polar Surface Area:65
Heavy Atom Count:16
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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