Home Carboxys Diethyl 1,1-cyclohexanedicarboxylate

Diethyl 1,1-cyclohexanedicarboxylate

CAS No.:
1139-13-5
Catalog Number:
AG000A1C
Molecular Formula:
C12H20O4
Molecular Weight:
228.2848
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$57
- +
5g
95%
In Stock USA
United States
$225
- +
10g
95%
In Stock USA
United States
$425
- +
25g
95%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG000A1C
Chemical Name:
Diethyl 1,1-cyclohexanedicarboxylate
CAS Number:
1139-13-5
Molecular Formula:
C12H20O4
Molecular Weight:
228.2848
MDL Number:
MFCD02093457
IUPAC Name:
diethyl cyclohexane-1,1-dicarboxylate
InChI:
InChI=1S/C12H20O4/c1-3-15-10(13)12(11(14)16-4-2)8-6-5-7-9-12/h3-9H2,1-2H3
InChI Key:
MLHUKQNAQSRVKI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCCCC1)C(=O)OCC
NSC Number:
67359
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.136g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.288g/mol
Monoisotopic Mass:
228.136g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties