1-Bromo-5-(bromomethyl)-3-fluoro-2-methylbenzene
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Basic information
- CAS
2090980-29-1- Standard SMILES
Cc1c(F)cc(CBr)cc1Br- InChIKey
GNGFOQFFDPAKIX-UHFFFAOYSA-N- Molecular formula
- C8H7Br2F
- Average molar mass
- 281.95 g/mol
Names & identifiers
- Preferred name
- 1-Bromo-5-(bromomethyl)-3-fluoro-2-methylbenzene
- IUPAC
- 1-bromo-5-(bromomethyl)-3-fluoro-2-methylbenzene
- English name
- Benzene, 1-bromo-5-(bromomethyl)-3-fluoro-2-methyl-
- Molecular formula
- C8H7Br2F
- Molecular weight
- 281.95
Names & synonyms
1-Bromo-5-(bromomethyl)-3-fluoro-2-methylbenzene2090980-29-13-bromo-5-fluoro-4-methylbenzyl bromideSCHEMBL22817324MFCD33405225D96263Benzene, 1-bromo-5-(bromomethyl)-3-fluoro-2-methyl-
Database identifiers
- CAS
2090980-29-1
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 129
Physicochemical properties
- Boiling point
- 268.9 · 268.9±35.0 °C(Predicted)
- Density
- 1.812 · 1.812±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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