HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Tricyclo(8.2.2.24,7)-hexadecane

HCID 136117
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
283-68-1
Standard SMILES
C1CC2CCC1CCC1CCC(CC1)CC2
InChIKey
NJKSNKVRWTTWPA-UHFFFAOYSA-N
Molecular formula
C16H28
Average molar mass
220.39 g/mol
Monoisotopic mass
220.21910089

Names & identifiers

Preferred name
Tricyclo(8.2.2.24,7)-hexadecane
IUPAC
tricyclo[8.2.2.24,7]hexadecane

Names & synonyms

Tricyclo(8.2.2.24,7)-hexadecaneTricyclo[8.2.2.24,7]hexadecane283-68-1Dodecahydro[2.2]paracyclophaneTricyclo[8.2.2.24,7]-hexadecaneSCHEMBL19232832DTXSID00182552tricyclo(8,2,2,24 ,7)hexadecaneTricyclo[8.2.2.2~4,7~]hexadecane

Database identifiers

CAS
283-68-1
PubChem CID
136117
DTXSID
DTXSID00182552
Nikkaji
J779.583A、J885.517J、J885.518H

Properties

Computed structural properties

XLogP
7.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
16
Formal charge
0
Complexity
156

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes