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Substance Name: (1S-(1alpha,2beta,5alpha))-2,6,6-Trimethylbicyclo(3.1.1)heptan-3-one
RN: 14575-93-0
InChIKey: MQPHVIPKLRXGDJ-RNJXMRFFSA-N

Molecular Formula

  • C10-H16-O

Molecular Weight

  • 152.235
 
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Names and Synonyms

Synonym

  • EINECS 238-619-5

Systematic Name

  • (1S-(1alpha,2beta,5alpha))-2,6,6-Trimethylbicyclo(3.1.1)heptan-3-one

Registry Numbers

CAS Registry Number

  • 14575-93-0

System Generated Number

  • 0014575930

Structure Descriptors

InChI

1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3/t6-,7+,8-/m0/s1

InChIKey

MQPHVIPKLRXGDJ-RNJXMRFFSA-N

Smiles

C1(C)([C@H]2CC([C@H]([C@H]1C2)C)=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 212 deg C   EXP
log P (octanol-water) 3.010 (none)   EST
Atmospheric OH Rate Constant 1.03E-11 cm3/molecule-sec 25 EST

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