Basic information
- CAS
3404-71-5- Standard SMILES
C=C(CC)CCC- InChIKey
TWCRBBJSQAZZQB-UHFFFAOYSA-N- Molecular formula
- C7H14
- Average molar mass
- 98.19 g/mol
- Monoisotopic mass
- 98.10955045
Names & identifiers
- Preferred name
- 3-Methylidenehexane
- IUPAC
- 3-methylidenehexane
Names & synonyms
3404-71-53-methylidenehexaneDTXSID90871024RefChem:1068314DTXCID708186992-ethyl-1-pentene1-Pentene, 2-ethyl-3-methylene-hexane2-ethyl-pent-1-eneSCHEMBL73470SCHEMBL486969SCHEMBL2120629
Show more names
SCHEMBL2121214SCHEMBL3848713SCHEMBL10676793SCHEMBL16288324SCHEMBL17219351TWCRBBJSQAZZQB-UHFFFAOYSA-NAKOS006273237
Database identifiers
- CAS
3404-71-5- PubChem CID
- 520668
- DTXSID
DTXSID90871024- Nikkaji
- J661.434E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 53.1
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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