2-Chloro-2-methylheptane
Basic information
- CAS
4325-49-9- Standard SMILES
CCCCCC(C)(C)Cl- InChIKey
VZYCLOQPZDXYHA-UHFFFAOYSA-N- Molecular formula
- C8H17Cl
- Average molar mass
- 148.67 g/mol
- Monoisotopic mass
- 148.1018782
Names & identifiers
- Preferred name
- 2-Chloro-2-methylheptane
- IUPAC
- 2-chloro-2-methylheptane
Names & synonyms
2-Chloro-2-methylheptane4325-49-9DTXSID60962978RefChem:1062741DTXCID301390752Heptane, 2-chloro-2-methyl-2-chloro-2-methyl-heptaneNSC4548SCHEMBL1538598SCHEMBL7863818NSC 4548NSC-4548
Database identifiers
- CAS
4325-49-9- PubChem CID
- 220974
- DTXSID
DTXSID60962978- Nikkaji
- J191.528B
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 67
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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