1,1,1-Tribromoheptane
Basic information
- CAS
62127-64-4- Standard SMILES
CCCCCCC(Br)(Br)Br- InChIKey
BJVGWLYIZWGQDH-UHFFFAOYSA-N- Molecular formula
- C7H13Br3
- Average molar mass
- 336.89 g/mol
- Monoisotopic mass
- 333.85674
Names & identifiers
- Preferred name
- 1,1,1-Tribromoheptane
- IUPAC
- 1,1,1-tribromoheptane
Names & synonyms
1,1,1-tribromoheptane1,1,1-tribromo-heptaneheptane, 1,1,1-tribromo-SCHEMBL960249SCHEMBL16970387DTXSID301350972InChI=1/C7H13Br3/c1-2-3-4-5-6-7(8,9)10/h2-6H2,1H62127-64-4
Database identifiers
- CAS
62127-64-4- PubChem CID
- 638096
- DTXSID
DTXSID301350972
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 75.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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