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Substance Name: Bicyclo(2.2.1)heptane (9CI)
RN: 279-23-2
InChIKey: UMRZSTCPUPJPOJ-UHFFFAOYSA-N

Molecular Formula

  • C7-H12

Molecular Weight

  • 96.1718
 
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Names and Synonyms

Synonyms

  • 1,4-Endomethylenecyclohexane
  • 4-05-00-00258 (Beilstein Handbook Reference)
  • AI3-51350
  • BRN 1900379
  • Cyclohexane, 1,4-endo-methylene-
  • EINECS 205-996-2
  • Norbornylane
  • Norcamphane
  • Norfenchane
  • Norsantane
  • NSC 91457

Systematic Names

  • Bicyclo(2.2.1)heptane
  • Bicyclo(2.2.1)heptane (9CI)
  • Norbornane

Registry Numbers

CAS Registry Number

  • 279-23-2

System Generated Number

  • 0000279232

Structure Descriptors

InChI

1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2

InChIKey

UMRZSTCPUPJPOJ-UHFFFAOYSA-N

Smiles

C12CC(CC1)CC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04038,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 87.5 deg C   EXP
Boiling Point 105.3 deg C   EXP
log P (octanol-water) 3.78 (none)   EXP
Water Solubility 84 mg/L 25 EST
Vapor Pressure 33 mm Hg 25 EST
Henry's Law Constant 0.149 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.49E-12 cm3/molecule-sec 25 EXP

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