Furan-3-acrylic Acid - CAS 39244-10-5

Catalog:	BB023911
Product Name:	Furan-3-acrylic Acid
CAS:	39244-10-5
Synonyms:	(E)-3-(3-furanyl)-2-propenoic acid; (E)-3-(furan-3-yl)prop-2-enoic acid

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Computed Properties

IUPAC Name:	(E)-3-(furan-3-yl)prop-2-enoic acid
Description:	Furan-3-acrylic Acid (CAS# 39244-10-5) is a reactant in the preparation of 7-aminofuro[2,3-c]pyridine inhibitors of TAK1.
Molecular Weight:	138.12
Molecular Formula:	C7H6O3
Canonical SMILES:	C1=COC=C1C=CC(=O)O
InChI:	InChI=1S/C7H6O3/c8-7(9)2-1-6-3-4-10-5-6/h1-5H,(H,8,9)/b2-1+
InChI Key:	JHAPZUDWRRBZHZ-OWOJBTEDSA-N
Boiling Point:	261.4 °C at 760 mmHg
Density:	1.28 g/cm³
Appearance:	Cream solid
MDL:	MFCD00075074
LogP:	1.37740

Publication Number	Title	Priority Date
CN-112708056-A	Viscosity-reducing polycarboxylate superplasticizer for concrete member and preparation method thereof	20201030
KR-20210101789-A	Composition for Preventing or Treating Hyperproliferative Vascular Disorders Comprising Derivative of 3-furanyl acrylate	20200211
WO-2021119554-A1	Compositions and methods for potentiating immune activity	20191212
WO-2021065898-A1	Azepan derivative	20190930
WO-2021029395-A1	Compound, polymer, composition, composition for film formation, pattern forming method, method for forming insulating film, method for producing compound, iodine-containing vinyl polymer and method for producing acetylated derivative of same	20190809

PMID	Publication Date	Title	Journal
21167710	20110501	Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A)	Bioorganic & medicinal chemistry letters

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
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[87-88-7]
Chloranilic acid
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
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[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid

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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:	151
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	138.031694049
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	138.031694049
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1