(4-Methylphenoxy)acetic acid - CAS 940-64-7

Name: (4-Methylphenoxy)acetic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB041181
Product Name:	(4-Methylphenoxy)acetic acid
CAS:	940-64-7
Synonyms:	2-(4-methylphenoxy)acetic acid

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Computed Properties

IUPAC Name:	2-(4-methylphenoxy)acetic acid
Description:	(4-Methylphenoxy)acetic acid (CAS# 940-64-7) is a useful research chemical.
Molecular Weight:	166.17
Molecular Formula:	C9H10O3
Canonical SMILES:	CC1=CC=C(C=C1)OCC(=O)O
InChI:	InChI=1S/C9H10O3/c1-7-2-4-8(5-3-7)12-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key:	SFTDDFBJWUWKMN-UHFFFAOYSA-N
Boiling Point:	297.2 °C at 760 mmHg
Melting Point:	141-142 °C
Purity:	95 %
Appearance:	Slightly beige crystalline powder
MDL:	MFCD00014365
LogP:	1.45840

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]C6H2Cl2O4
Chloranilic acid
[17746-05-3]C11H21ClO
Undecanoyl chloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

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

Publication Number	Title	Priority Date
WO-2021119554-A1	Compositions and methods for potentiating immune activity	20191212
CN-110724115-B	Method for preparing 2-amino-5-substituted-1, 3, 4-thiadiazole	20191024
WO-2021011670-A1	Adenosine a2a receptor antagonists and uses thereof	20190717
CN-111493078-A	Use of piperazinone derivatives, an accelerator and a method for controlling root parasitic weeds	20190131
US-2020241414-A1	Resist composition and patterning process	20190129

Complexity:	148
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	166.062994177
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	166.062994177
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9