Home Carboxys 2-methyl-4-(2-methylpropyl)-5-oxooxolane-2-carboxylic acid

2-methyl-4-(2-methylpropyl)-5-oxooxolane-2-carboxylic acid

CAS No.:
40344-07-8
Catalog Number:
AG01DWER
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DWER
Chemical Name:
2-methyl-4-(2-methylpropyl)-5-oxooxolane-2-carboxylic acid
CAS Number:
40344-07-8
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
MDL Number:
MFCD24485580
IUPAC Name:
2-methyl-4-(2-methylpropyl)-5-oxooxolane-2-carboxylic acid
InChI:
InChI=1S/C10H16O4/c1-6(2)4-7-5-10(3,9(12)13)14-8(7)11/h6-7H,4-5H2,1-3H3,(H,12,13)
InChI Key:
JXXZNVBUQDPAPM-UHFFFAOYSA-N
SMILES:
CC(CC1CC(OC1=O)(C)C(=O)O)C
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.234g/mol
Monoisotopic Mass:
200.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties