Home Other Building Blocks Benzoic acid, 4-(1-cyclopenten-1-yl)-

Benzoic acid, 4-(1-cyclopenten-1-yl)-

CAS No.:
19936-21-1
Catalog Number:
AG002C3S
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
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Product Description
Catalog Number:
AG002C3S
Chemical Name:
Benzoic acid, 4-(1-cyclopenten-1-yl)-
CAS Number:
19936-21-1
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
MDL Number:
MFCD20644073
IUPAC Name:
4-(cyclopenten-1-yl)benzoic acid
InChI:
InChI=1S/C12H12O2/c13-12(14)11-7-5-10(6-8-11)9-3-1-2-4-9/h3,5-8H,1-2,4H2,(H,13,14)
InChI Key:
BWCBPFAOWPSQBS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)C1=CCCC1
NSC Number:
126981
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties