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Substance Name: 1,2,3,4-Tetrahydrocarbazole
RN: 942-01-8
UNII: 8ZLK0TSX93
InChIKey: XKLNOVWDVMWTOB-UHFFFAOYSA-N

Molecular Formula

  • C12-H13-N

Molecular Weight

  • 171.2417
 
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Names and Synonyms

Name of Substance

  • 1,2,3,4-Tetrahydrocarbazole

Synonyms

  • 1,2,3,4-Tetrahydrocarbazole
  • 1H-Indole, 2,3-(1,4-butanediyl)-
  • 2,3,4,9-Tetrahydro-1H-carbazole
  • 2,3-Tetramethylene-1H-indole
  • 2,3-Tetramethyleneindole
  • 5,6,7,8-Tetrahydrocarbazole
  • 5-20-07-00468 (Beilstein Handbook Reference)
  • BRN 0133771
  • Carbazole, 5,6,7,8-tetrahydro-
  • EINECS 213-385-7
  • NSC 17329
  • UNII-8ZLK0TSX93

Systematic Names

  • 1,2,3,4-Tetrahydrocarbazole
  • 1H-Carbazole, 2,3,4,9-tetrahydro- (9CI)
  • Carbazole, 1,2,3,4-tetrahydro- (8CI)
  • Carbazole, 5,6,7,8-tetrahydro-

Registry Numbers

CAS Registry Number

  • 942-01-8

FDA UNII

  • 8ZLK0TSX93

System Generated Number

  • 0000942018

Structure Descriptors

InChI

1S/C12H13N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1,3,5,7,13H,2,4,6,8H2

InChIKey

XKLNOVWDVMWTOB-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c3c([nH]2)CCCC3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 2650mg/kg (2650mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 99, Pg. 450, 1950.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 120 deg C   EXP
Boiling Point 327.5 deg C   EXP
log P (octanol-water) 4.020 (none)   EST
Atmospheric OH Rate Constant 2.05E-10 cm3/molecule-sec 25 EST

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