Home Carboxys 1-Cyclopentene-1-carboxylic acid, 3-oxo-, radical ion(1+) (9CI)

1-Cyclopentene-1-carboxylic acid, 3-oxo-, radical ion(1+) (9CI)

CAS No.:
196496-02-3
Catalog Number:
AG00AXYW
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00AXYW
Chemical Name:
1-Cyclopentene-1-carboxylic acid, 3-oxo-, radical ion(1+) (9CI)
CAS Number:
196496-02-3
IUPAC Name:
3-oxocyclopentene-1-carboxylic acid
InChI:
InChI=1S/C6H6O3/c7-5-2-1-4(3-5)6(8)9/h3H,1-2H2,(H,8,9)
InChI Key:
OVRALHWIAFCVSV-UHFFFAOYSA-N
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.032g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.111g/mol
Monoisotopic Mass:
126.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties