(3,5-Dimethoxyphenyl)acetic acid

Product Information

Molecular Formula:
C10H12O4
Molecular Weight:
196.20
Description
(3,5-Dimethoxyphenyl)acetic acid (CAS# 4670-10-4) is a general reactant/reagent used in the synthesis of a recyclable, immobilized analogue of Benzotetramisole.
Synonyms
2-(3,5-dimethoxyphenyl)acetic acid
IUPAC Name
2-(3,5-dimethoxyphenyl)acetic acid
Canonical SMILES
COC1=CC(=CC(=C1)CC(=O)O)OC
InChI
InChI=1S/C10H12O4/c1-13-8-3-7(5-10(11)12)4-9(6-8)14-2/h3-4,6H,5H2,1-2H3,(H,11,12)
InChI Key
FFPAFDDLAGTGPQ-UHFFFAOYSA-N
Boiling Point
293.08 ℃ (rough estimate)
Melting Point
102-103 ℃ (lit.)
Purity
> 98.0 % (T)
Density
1.189 g/cm3
Appearance
White to orange to green powder to crystal
Refractive Index
1.5430 (estimate)
LogP
1.33090

Safety Information

Hazards
H319 H335
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

Computed Properties

XLogP3
1.3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
4
Exact Mass
196.07355886 g/mol
Monoisotopic Mass
196.07355886 g/mol
Topological Polar Surface Area
55.8Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
181
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

Patents

Publication Number Title Priority Date
CN-113121485-A 3-aryl coumarin derivative and preparation method and application thereof 2021-03-01
KR-20220007755-A Dicing film and dicing die bonding film 2020-07-09
JP-2021109952-A Curable Adhesive Composition, Adhesive Tape, Semiconductor Wafer Processing Method, and Semiconductor Device Manufacturing Method 2020-01-09
JP-6799186-B1 Curable Adhesive Composition, Adhesive Tape, Semiconductor Wafer Processing Method, and Semiconductor Device Manufacturing Method 2020-01-09
WO-2021113620-A1 Acylated active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease 2019-12-05
WO-2021113635-A1 Acylated active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease 2019-12-05
WO-2021093758-A1 Pyrimido derivative and application thereof in medicine 2019-11-15
TW-202128672-A A kind of pyrimido ring derivative and its application in medicine 2019-11-15
WO-2021081515-A2 Compositions and methods for the treatment of human immunodeficiency virus 2019-10-25
WO-2021050612-A1 Compositions and methods for the treatment of respiratory syncytial virus 2019-09-09

Literatures

PMID Publication Date Title Journal
21048342 2010-11-01 Efficient synthesis of natural polyphenolic stilbenes: resveratrol, piceatannol and oxyresveratrol Chemical & pharmaceutical bulletin
21580779 2010-03-30 Methyl 3,5-dibromo-4-methyl-benzoate Acta crystallographica. Section E, Structure reports online
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

Related Products

Online Inquiry
  • Verification code
USA
  • International:
  • US & Canada (Toll free):
  • Email:
  • Fax:
UK
  • Email:
Copyright © 2024 BOC Sciences. All rights reserved.
Inquiry Basket