Home Carboxys 2-oxobicyclo[3.1.0]hexane-6-carboxylic acid

2-oxobicyclo[3.1.0]hexane-6-carboxylic acid

CAS No.:
176027-94-4
Catalog Number:
AG019TZ0
Molecular Formula:
C7H8O3
Molecular Weight:
140.1366
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Product Description
Catalog Number:
AG019TZ0
Chemical Name:
2-oxobicyclo[3.1.0]hexane-6-carboxylic acid
CAS Number:
176027-94-4
Molecular Formula:
C7H8O3
Molecular Weight:
140.1366
MDL Number:
MFCD19228573
IUPAC Name:
2-oxobicyclo[3.1.0]hexane-6-carboxylic acid
InChI:
InChI=1S/C7H8O3/c8-4-2-1-3-5(4)6(3)7(9)10/h3,5-6H,1-2H2,(H,9,10)
InChI Key:
JUIOQBDYJXJVSZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1C2C1CCC2=O
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.047g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.138g/mol
Monoisotopic Mass:
140.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties