Home Other Building Blocks Dimethyl adipate

Dimethyl adipate

CAS No.:
627-93-0
Catalog Number:
AG0034R2
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$19
- +
100g
95%
In Stock USA
United States
$50
- +
500g
95%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG0034R2
Chemical Name:
Dimethyl adipate
CAS Number:
627-93-0
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD00008469
IUPAC Name:
dimethyl hexanedioate
InChI:
InChI=1S/C8H14O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-6H2,1-2H3
InChI Key:
UDSFAEKRVUSQDD-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCC(=O)OC
EC Number:
211-020-6
UNII:
BY71RX0R62
NSC Number:
11213
FEMA Number:
4472
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.196g/mol
Monoisotopic Mass:
174.089g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Effect of alcohol structure on the optimum condition for novozym 435-catalyzed synthesis of adipate esters. Biotechnology research international 20110101
Lipase-catalyzed dimethyl adipate synthesis: response surface modeling and kinetics. Biotechnology journal 20100801
Characterization of pyrolysis products from a biodiesel phenolic urethane binder. Environmental science & technology 20090301
Bis(4-pyridylmeth-yl) hexa-nedioate. Acta crystallographica. Section E, Structure reports online 20080601
[A new flavonoid from heartwood of Caesalpinia sappan]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20080401
Preparation and characterization of hydroxyapatite/poly(ethylene adipate) hybrid composites. Journal of biomaterials science. Polymer edition 20080101
Chemoenzymatic synthesis and chemical recycling of sustainable polyurethanes. ChemSusChem 20080101
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. Journal of molecular graphics & modelling 20061101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
[GC-MS analysis of the fatty components of pollen Typhae before and after being carbonized]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20060201
Matrix-assisted laser desorption/ionization time-of-flight/time-of-flight tandem mass spectra of poly(butylene adipate). Rapid communications in mass spectrometry : RCM 20060101
Induction of heat shock protein 70 in rat olfactory epithelium by toxic chemicals: in vitro and in vivo studies. Archives of toxicology 20050401
Sites and mechanisms for uptake of gases and vapors in the respiratory tract. Toxicology 20010307
Properties