Cas no 6120-13-4 (Bicyclo[2.2.1]heptane,2-chloro-1,7,7-trimethyl-)

Bicyclo[2.2.1]heptane,2-chloro-1,7,7-trimethyl- structure
6120-13-4 structure
Product Name:Bicyclo[2.2.1]heptane,2-chloro-1,7,7-trimethyl-
CAS No:6120-13-4
MF:C10H17Cl
MW:172.694982290268
CID:525638
PubChem ID:10048
Update Time:2025-04-19

Bicyclo[2.2.1]heptane,2-chloro-1,7,7-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[2.2.1]heptane,2-chloro-1,7,7-trimethyl-
    • Bornane,2-chloro- (6CI,7CI)
    • Camphane, 2-chloro- (2CI)
    • NSC 243650
    • Bornylchlorid
    • Bicyclo[2.2.1]heptane, 2-chloro-1,7,7-trimethyl-, endo-
    • PD162882
    • Bornyl chloride
    • endo-2-Chlorobornane
    • BCP32503
    • NSC-243650
    • SCHEMBL457759
    • 2-Chloro-1,7,7-trimethylbicyclo[2.2.1]heptane
    • Bicyclo[2.2.1]heptane, 2-chloro-1,7,7-trimethyl-, exo-
    • Bornane, 2-chloro-, exo-
    • AS-57278
    • AKOS037645122
    • XXZAOMJCZBZKPV-UHFFFAOYSA-N
    • 2-Chloro-1,7,7-trimethylbicyclo[2.2.1]heptane #
    • Bornyl chloride;2-Chlorocamphane;Turpentine camphor
    • Isobornyl chloride
    • 6120-13-4
    • NSC243650
    • Inchi: 1S/C10H17Cl/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3
    • InChI Key: XXZAOMJCZBZKPV-UHFFFAOYSA-N
    • SMILES: ClC1CC2CCC1(C)C2(C)C

Computed Properties

  • Exact Mass: 172.10201
  • Monoisotopic Mass: 172.1018782g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 185
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 1.01±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 142-150 oC (methanol mixture of isomers)
  • Boiling Point: 207.5±0.0 oC (760 Torr),
  • Flash Point: 68.0±4.5 oC,
  • Solubility: Insuluble (8.3E-3 g/L) (25 oC),
  • PSA: 0
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