2-(2-Furanyl)acetic Acid - CAS 2745-26-8

Catalog:	BB019571
Product Name:	2-(2-Furanyl)acetic Acid
CAS:	2745-26-8
Synonyms:	2-(2-furanyl)acetic acid; 2-(furan-2-yl)acetic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-(furan-2-yl)acetic acid
Description:	2-(2-Furanyl)acetic Acid (CAS# 2745-26-8) is one of the compounds detected in tobacco smoke condensate.
Molecular Weight:	126.11
Molecular Formula:	C6H6O3
Canonical SMILES:	C1=COC(=C1)CC(=O)O
InChI:	InChI=1S/C6H6O3/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2,(H,7,8)
InChI Key:	VYSRZETUSAOIMP-UHFFFAOYSA-N
Boiling Point:	233.8 °C at 760 mmHg
Density:	1.265 g/cm³
Appearance:	Solid
MDL:	MFCD00798036
LogP:	0.90670

Publication Number	Title	Priority Date
CN-112778241-A	Preparation method of tetrahydrofuran acetic acid and ester compound thereof	20210309
CN-112898264-A	Method for preparing epsilon-caprolactone, 6-hydroxycaproic acid and esters thereof by using furan acetic acid and esters thereof	20210309
CN-112707919-A	Method for synthesizing 3-decarbamoyl cefuroxime acid by using graphene-supported copper catalyst	20201230
CN-112156617-A	Method for recycling waste gas generated by synthesizing furanone acid	20200916
CN-111440196-A	Method for nickel-based catalytic synthesis of 3-decarbamoyl cefuroxime acid	20200522

PMID	Publication Date	Title	Journal
21098431	20110101	Paintomics: a web based tool for the joint visualization of transcriptomics and metabolomics data	Bioinformatics (Oxford, England)
14669971	20031001	Lack of stereospecificity in lysophosphatidic acid enantiomer-induced calcium mobilization in human erythroleukemia cells	Lipids

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	111
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	126.031694049
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	126.031694049
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6