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Substance Name: Adipic acid, dipropyl ester
RN: 106-19-4
UNII: WB3LW508W0
InChIKey: NKOUWLLFHNBUDW-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C12-H22-O4

Molecular Weight

  • 230.302
 
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Names and Synonyms

Name of Substance

  • Adipic acid, dipropyl ester
  • Dipropyl adipate
  • Dipropyl hexanedioate
  • Hexanedioic acid, dipropyl ester

Synonyms

  • 4-02-00-01961 (Beilstein Handbook Reference)
  • Adipic acid, di-n-propyl ester
  • AI3-06052
  • BRN 1785512
  • Di-n-propyl adipate
  • Dipropyl adipate
  • Dipropyl hexanedioate
  • EINECS 203-371-9
  • NSC 4894
  • UNII-WB3LW508W0

Systematic Names

  • Adipic acid, dipropyl ester
  • Dipropyl adipate
  • Hexanedioic acid, 1,6-dipropyl ester
  • Hexanedioic acid, dipropyl ester

Registry Numbers

CAS Registry Number

  • 106-19-4

FDA UNII

  • WB3LW508W0

System Generated Number

  • 0000106194

Structure Descriptors

InChI

1S/C12H22O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-10H2,1-2H3

InChIKey

NKOUWLLFHNBUDW-UHFFFAOYSA-N

Smiles

C(CCCCC(OCCC)=O)(OCCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 3786uL/kg (3.786mL/kg)   Journal of Pharmaceutical Sciences. Vol. 62, Pg. 1596, 1973.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -1.57E+01 deg C   EXP
log P (octanol-water) 3.350 (none)   EST
Atmospheric OH Rate Constant 9.85E-12 cm3/molecule-sec 25 EST

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