Home Carboxys 3,5-Dioxocyclohexanecarboxylic acid

3,5-Dioxocyclohexanecarboxylic acid

CAS No.:
42858-60-6
Catalog Number:
AG00BXRW
Molecular Formula:
C7H8O4
Molecular Weight:
156.1360
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00BXRW
Chemical Name:
3,5-Dioxocyclohexanecarboxylic acid
CAS Number:
42858-60-6
Molecular Formula:
C7H8O4
Molecular Weight:
156.1360
MDL Number:
MFCD09836162
IUPAC Name:
3,5-dioxocyclohexane-1-carboxylic acid
InChI:
InChI=1S/C7H8O4/c8-5-1-4(7(10)11)2-6(9)3-5/h4H,1-3H2,(H,10,11)
InChI Key:
MCGPFJGIBKPQGO-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CC(C1)C(=O)O
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.042g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.137g/mol
Monoisotopic Mass:
156.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties