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Substance Name: 1,2-Diethylbenzene
RN: 135-01-3
UNII: 25HOX6T1LU
InChIKey: KVNYFPKFSJIPBJ-UHFFFAOYSA-N

Molecular Formula

  • C10-H14

Molecular Weight

  • 134.221
 
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Names and Synonyms

Name of Substance

  • 1,2-Diethylbenzene

Synonyms

  • 4-05-00-01065 (Beilstein Handbook Reference)
  • Benzene, 1,2-diethyl-
  • Benzene, o-diethyl-
  • BRN 1904392
  • EINECS 205-170-1
  • HSDB 4081
  • o-Diethylbenzene
  • UNII-25HOX6T1LU

Systematic Names

  • Benzene, 1,2-diethyl-
  • Benzene, o-diethyl-
  • o-Diethylbenzene

Superlist Names

  • Benzene, 1,2-diethyl-
  • o-Diethylbenzene

Registry Numbers

CAS Registry Number

  • 135-01-3

FDA UNII

  • 25HOX6T1LU

System Generated Number

  • 0000135013

Structure Descriptors

InChI

1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3

InChIKey

KVNYFPKFSJIPBJ-UHFFFAOYSA-N

Smiles

c1(c(cccc1)CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 5gm/kg (5000mg/kg)   "Toxicology and Biochemistry of Aromatic Hydrocarbons," Gerarde, H., New York, Elsevier, 1960Vol. -, Pg. 57, 1960.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.12E+01 deg C   EXP
Boiling Point 184 deg C   EXP
log P (octanol-water) 3.72 (none)   EXP
Water Solubility 71.1 mg/L 20 EXP
Vapor Pressure 1.05 mm Hg 25 EXP
Henry's Law Constant 2.61E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.11E-12 cm3/molecule-sec 25 EST

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