Bornane
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Basic information
- CAS
464-15-3- Standard SMILES
CC12CCC(CC1)C2(C)C- InChIKey
BEWYHVAWEKZDPP-UHFFFAOYSA-N- Molecular formula
- C10H18
- Average molar mass
- 138.25 g/mol
- Monoisotopic mass
- 138.14085057
Overview
Bornane is a monoterpene and a terpenoid fundamental parent.
Names & identifiers
- Preferred name
- Bornane
- IUPAC
- 1,7,7-trimethylbicyclo[2.2.1]heptane
- English name
- bornane
- Molecular formula
- C10H18
- Molecular weight
- 138.25
Names & synonyms
CamphaneBornane1,7,7-Trimethylbicyclo[2.2.1]heptaneBornylane464-15-31,7,7-Trimethylbicyclo(2.2.1)heptaneCHEBI:35783DTXSID60196832RefChem:123137DTXCID001193231beta,4beta-bornane38451-93-3
Show more names
Camphane, BornaneCamphane in n-hexane1,7,7-Trimethylbicyclo[2.2.1]heptane97%1,7,7-Trimethylbicyclo[2.2.1]heptane 97%1,7,7-Trimethylbicyclo[2.2.1]heptane 95+%
Bornane skeletonBicyclo[2.2.1]heptane, 1,7,7-trimethyl-(1s,4s)-1,7,7-trimethylbicyclo[2.2.1]heptane1,7,7-Trimethylbicyclo-[2.2.1]heptaneCAEBicyclo(2.2.1)heptane, 1,7,7-trimethyl-NSC 17531SCHEMBL8427
Database identifiers
- CAS
464-15-3- PubChem CID
- 92108
- DTXSID
DTXSID60196832- ChEBI
CHEBI:35783- Nikkaji
- J11.345J
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 147
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- 158.5 °C · 158.5 °C
- Boiling point
- 188.7 °C · 188.7°C (rough estimate)
- Density
- 0.8102 · 0.8102 (estimate)
- refractive index
- 1.486 · 1.4860 (estimate)
- LogP
- 4.431 · 4.431 (est)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2902900000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Additional notes
DefinitionChEBI: Bornane is a terpenoid fundamental parent and a monoterpene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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