Deprecated ChemSpider Record

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ChemSpider 2D Image | (1S)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-carbonyl chloride | C11H17ClO

(1S)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-carbonyl chloride

  • Molecular FormulaC11H17ClO
  • Average mass200.705 Da
  • Monoisotopic mass200.096786 Da
  • ChemSpider ID25937620

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

Date of deprecation: 13:16, Sep 11, 2017
Reason for deprecation: Deprecate record: nonsensical structure - can't have stereochemistry defined on only one side of this bicyclic system

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1S)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-carbonylchlorid [German] [ACD/IUPAC Name]
(1S)-1,7,7-Trimethylbicyclo[2.2.1]heptane-2-carbonyl chloride [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-2-carbonyl chloride, 1,7,7-trimethyl-, (1S)- [ACD/Index Name]
Chlorure de (1S)-1,7,7-triméthylbicyclo[2.2.1]heptane-2-carbonyle [French] [ACD/IUPAC Name]
(1s)-camphanoyl chloride
39637-74-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 225.6±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.2±3.0 kJ/mol
Flash Point: 115.8±8.3 °C
Index of Refraction: 1.494
Molar Refractivity: 53.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 373.86
ACD/KOC (pH 5.5): 2416.29
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 373.86
ACD/KOC (pH 7.4): 2416.29
Polar Surface Area: 17 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 33.6±3.0 dyne/cm
Molar Volume: 184.5±3.0 cm3

Click to predict properties on the Chemicalize site


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