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Home Other Building Blocks (2E)-3-(5-Methyl-2-furyl)acrylic acid

(2E)-3-(5-Methyl-2-furyl)acrylic acid

CAS No.:
14779-25-0
Catalog Number:
AG001F7I
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
98%
In Stock USA
United States
$113
- +
1g
98%
In Stock USA
United States
$138
- +
Product Description
Catalog Number:
AG001F7I
Chemical Name:
(2E)-3-(5-Methyl-2-furyl)acrylic acid
CAS Number:
14779-25-0
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
MDL Number:
MFCD00186942
IUPAC Name:
(E)-3-(5-methylfuran-2-yl)prop-2-enoic acid
InChI:
InChI=1S/C8H8O3/c1-6-2-3-7(11-6)4-5-8(9)10/h2-5H,1H3,(H,9,10)/b5-4+
InChI Key:
CQCKLDAUFPKXPU-SNAWJCMRSA-N
SMILES:
Cc1ccc(o1)C=CC(=O)O
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
152.047g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.149g/mol
Monoisotopic Mass:
152.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A). Bioorganic & medicinal chemistry letters 20110501
Design, synthesis and pharmacobiological evaluation of novel acrylic acid derivatives acting as lipoxygenase and cyclooxygenase-1 inhibitors with antioxidant and anti-inflammatory activities. European journal of medicinal chemistry 20110101
Properties