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Substance Name: Neopentyl glycol dioctanoate
RN: 28510-23-8
UNII: U68ZV6W62C
InChIKey: GORMSINSWZJIKL-UHFFFAOYSA-N

Molecular Formula

  • C21-H40-O4

Molecular Weight

  • 356.543
 
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Names and Synonyms

Name of Substance

  • Neopentyl glycol dioctanoate
  • Octanoic acid, 2,2-dimethyl-1,3-propanediol diester

Synonyms

  • EC 249-060-1
  • EINECS 249-060-1
  • Neopentyl glycol di(2-ethylhexanoate)
  • Neopentyl glycol di(2-ethylhexoate)
  • UNII-U68ZV6W62C

Systematic Names

  • 2,2-Dimethylpropane-1,3-diyl 2-ethylhexanoate
  • Hexanoic acid, 2-ethyl-, 1,1'-(2,2-dimethyl-1,3-propanediyl) ester
  • Hexanoic acid, 2-ethyl-, 2,2-dimethyl-1,3-propanediyl ester

Registry Numbers

CAS Registry Number

  • 28510-23-8

FDA UNII

  • U68ZV6W62C

System Generated Number

  • 0028510238

Structure Descriptors

InChI

1S/C21H40O4/c1-7-11-13-17(9-3)19(22)24-15-21(5,6)16-25-20(23)18(10-4)14-12-8-2/h17-18H,7-16H2,1-6H3

InChIKey

GORMSINSWZJIKL-UHFFFAOYSA-N

Smiles

C([C@@H](CCCC)CC)(OCC(COC([C@@H](CCCC)CC)=O)(C)C)=O