Basic information
- CAS
62185-30-2- Standard SMILES
CCCC(CCC)C(C)C(C)C- InChIKey
AZUDVOIXPNEOLR-UHFFFAOYSA-N- Molecular formula
- C12H26
- Average molar mass
- 170.33 g/mol
- Monoisotopic mass
- 170.20345083
Names & identifiers
- Preferred name
- 2,3-Dimethyl-4-propylheptane
- IUPAC
- 2,3-dimethyl-4-propylheptane
Names & synonyms
2,3-DIMETHYL-4-PROPYLHEPTANE62185-30-2DTXSID40699992RefChem:245032DTXCID00650741SCHEMBL9582999
Database identifiers
- CAS
62185-30-2- PubChem CID
- 53428958
- DTXSID
DTXSID40699992
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 88.2
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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