1,1,1,3-Tetrabromopropane
Basic information
- CAS
62127-50-8- Standard SMILES
BrCCC(Br)(Br)Br- InChIKey
LMDGQLHMKMPGHY-UHFFFAOYSA-N- Molecular formula
- C3H4Br4
- Average molar mass
- 359.68 g/mol
- Monoisotopic mass
- 355.70465
Names & identifiers
- Preferred name
- 1,1,1,3-Tetrabromopropane
- IUPAC
- 1,1,1,3-tetrabromopropane
Names & synonyms
1,1,1,3-tetrabromopropanepropane, 1,1,1,3-tetrabromo-SCHEMBL9719527DTXSID601350626InChI=1/C3H4Br4/c4-2-1-3(5,6)7/h1-2H62127-50-8
Database identifiers
- CAS
62127-50-8- PubChem CID
- 638095
- DTXSID
DTXSID601350626
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 45.4
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
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Related reactions
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Compound notes
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