2,2,4-Trimethyl-1,3-pentanediol diisobutyrate
CAS Registry Number®
6846-50-0
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CAS Name
2,2,4-Trimethyl-1,3-pentanediol diisobutyrateMolecular Formula
C16H30O4Molecular Mass
286.41Cite this Page
2,2,4-Trimethyl-1,3-pentanediol diisobutyrate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=6846-50-0 (retrieved ) (CAS RN: 6846-50-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
280 °CDensity (2)
0.941 g/cm³
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C16H30O4/c1-10(2)13(20-15(18)12(5)6)16(7,8)9-19-14(17)11(3)4/h10-13H,9H2,1-8H3
InChIKey
InChIKey=OMVSWZDEEGIJJI-UHFFFAOYSA-N
SMILES
C(C(COC(C(C)C)=O)(C)C)(OC(C(C)C)=O)C(C)C
Canonical SMILES
O=C(OCC(C)(C)C(OC(=O)C(C)C)C(C)C)C(C)C
Other Names for this Substance
- Propanoic acid, 2-methyl-, 1,1′-[2,2-dimethyl-1-(1-methylethyl)-1,3-propanediyl] ester
- Isobutyric acid, 1-isopropyl-2,2-dimethyltrimethylene ester
- Propanoic acid, 2-methyl-, 2,2-dimethyl-1-(1-methylethyl)-1,3-propanediyl ester
- 1,3-Pentanediol, 2,2,4-trimethyl-, diisobutyrate
- Kodaflex TXIB
Deleted or Replaced CAS Registry Numbers
53490-81-6, 939776-40-6, 1206955-85-2