Home Other Building Blocks 2-Ethylglutaric acid dimethyl ester

2-Ethylglutaric acid dimethyl ester

CAS No.:
53481-05-3
Catalog Number:
AG0039GP
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$288
- +
1g
95%
In Stock USA
United States
$730
- +
Product Description
Catalog Number:
AG0039GP
Chemical Name:
2-Ethylglutaric acid dimethyl ester
CAS Number:
53481-05-3
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD18970620
IUPAC Name:
dimethyl 2-ethylpentanedioate
InChI:
InChI=1S/C9H16O4/c1-4-7(9(11)13-3)5-6-8(10)12-2/h7H,4-6H2,1-3H3
InChI Key:
UTUQNPLMHJIJDM-UHFFFAOYSA-N
SMILES:
COC(=O)CCC(C(=O)OC)CC
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties