Home Other Building Blocks 2-cyclopentylidenepropanoic acid

2-cyclopentylidenepropanoic acid

CAS No.:
81303-03-9
Catalog Number:
AG019Z07
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
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Product Description
Catalog Number:
AG019Z07
Chemical Name:
2-cyclopentylidenepropanoic acid
CAS Number:
81303-03-9
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
MDL Number:
MFCD13192695
IUPAC Name:
2-cyclopentylidenepropanoic acid
InChI:
InChI=1S/C8H12O2/c1-6(8(9)10)7-4-2-3-5-7/h2-5H2,1H3,(H,9,10)
InChI Key:
CWUGOLONOBYVMN-UHFFFAOYSA-N
SMILES:
CC(=C1CCCC1)C(=O)O
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Synthesis and biological evaluation of cycloalkylidene carboxylic acids as novel effectors of Ras/Raf interaction. Journal of medicinal chemistry 20020328
Properties