1,1-Diethylcyclopentane
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Basic information
- CAS
2721-38-2- Standard SMILES
CCC1(CC)CCCC1- InChIKey
DPGQSDLGKGLNHC-UHFFFAOYSA-N- Molecular formula
- C9H18
- Average molar mass
- 126.24 g/mol
- Monoisotopic mass
- 126.14085057
Names & identifiers
- Preferred name
- 1,1-Diethylcyclopentane
- IUPAC
- 1,1-diethylcyclopentane
- English name
- 1,1-Diethylcyclopentane.
- Molecular formula
- C9H18
- Molecular weight
- 126.24
Names & synonyms
1,1-diethylcyclopentane2721-38-2DTXSID10334308RefChem:1051766DTXCID80285398Cyclopentane, 1,1-diethyl-diethylcyclopentaneSCHEMBL258284SCHEMBL5726524SCHEMBL6591264SCHEMBL12475450SCHEMBL15538148
Show more names
1,1-Diethylcyclopentane.
DPGQSDLGKGLNHC-UHFFFAOYSA-N
Database identifiers
- CAS
2721-38-2- PubChem CID
- 520297
- DTXSID
DTXSID10334308
Properties
Computed structural propertiesFilling in
- XLogP
- 4.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 72
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- -95.6 °C · -95.6°C
- Boiling point
- 149.42 °C · 149.42°C (estimate)
- Density
- 0.7988 · 0.7988
- refractive index
- 1.4363 · 1.4363
- Henry's Law Constant
- 6.7 · 6.7×10-6 mol/(m3Pa) at 25℃, Yaws (2003)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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