Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Diisopropyl adipate
RN: 6938-94-9
UNII: P7E6YFV72X
InChIKey: ZDQWESQEGGJUCH-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H22-O4

Molecular Weight

  • 230.302
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Diisopropyl adipate

Name of Substance

  • Bis(1-methylethyl)hexanedioate
  • Diisopropyl adipate
  • Hexanedioic acid, bis(1-methylethyl) ester

Synonyms

  • 4-02-00-01961 (Beilstein Handbook Reference)
  • AI3-06066
  • beta dia
  • BRN 1785346
  • Ceraphyl 230
  • Crodamol DA
  • Diisopropyl adipat
  • Diisopropyl adipat [IUPAC]
  • Diisopropyl adipate
  • EC 230-072-0
  • EINECS 230-072-0
  • Iso-adipate 2/043700
  • Isopropyl adipate
  • NSC 56587
  • Prodipate
  • Schercemol DIA
  • Standamul DIPA
  • Tegester 504-D
  • UNII-P7E6YFV72X
  • Wickenol 116

Systematic Names

  • Adipic acid, diisopropyl ester
  • Diisopropyl adipate
  • Hexanedioic acid, 1,6-bis(1-methylethyl) ester
  • Hexanedioic acid, bis(1-methylethyl) ester

Superlist Names

  • Adipic acid, diisopropyl ester
  • Diisopropyl adipate

Registry Numbers

CAS Registry Number

  • 6938-94-9

FDA UNII

  • P7E6YFV72X

Other Registry Number

  • 121879-14-9

System Generated Number

  • 0006938949

Structure Descriptors

InChI

1S/C12H22O4/c1-9(2)15-11(13)7-5-6-8-12(14)16-10(3)4/h9-10H,5-8H2,1-4H3

InChIKey

ZDQWESQEGGJUCH-UHFFFAOYSA-N

Smiles

O(C(CCCCC(OC(C)C)=O)=O)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 640mg/kg (640mg/kg)   U.S. Army, Chemical Corps Medical Laboratories Research Reports. Vol. #256, Pg. 1954,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.10E+00 deg C   EXP
log P (octanol-water) 3.200 (none)   EST
Atmospheric OH Rate Constant 1.04E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.