Home Other Building Blocks 2-Propenoic acid, 3-(3-furanyl)-, (2E)-

2-Propenoic acid, 3-(3-furanyl)-, (2E)-

CAS No.:
81311-95-7
Catalog Number:
AG00G4XD
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00G4XD
Chemical Name:
2-Propenoic acid, 3-(3-furanyl)-, (2E)-
CAS Number:
81311-95-7
MDL Number:
MFCD00075074
IUPAC Name:
(E)-3-(furan-3-yl)prop-2-enoic acid
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
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
138.032g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.122g/mol
Monoisotopic Mass:
138.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A). Bioorganic & medicinal chemistry letters 20110501
Properties