Basic information
- CAS
53874-67-2- Standard SMILES
BrC(Br)c1cccc(Oc2ccccc2)c1- InChIKey
XGCVFGOKEISJGC-UHFFFAOYSA-N- Molecular formula
- C13H10Br2O
- Average molar mass
- 342.02 g/mol
- Monoisotopic mass
- 339.90983914
Names & identifiers
- Preferred name
- 1-(Dibromomethyl)-3-phenoxybenzene
- IUPAC
- 1-(dibromomethyl)-3-phenoxybenzene
- English name
- 1-(dibromomethyl)-3-phenoxybenzene
- Molecular formula
- C13H10Br2O
- Molecular weight
- 342.03
Names & synonyms
1-(Dibromomethyl)-3-phenoxybenzeneEINECS 258-832-7Benzene, 1-(dibromomethyl)-3-phenoxy-DTXSID3068887RefChem:74668DTXCID9041520258-832-753874-67-2m-phenoxybenzylidene dibromidem-Phenoxybenzalbromidm-phenoxybenzal bromideKRG35B7CQJ
Show more names
SCHEMBL9774444DB-311213NS00032862
Database identifiers
- CAS
53874-67-2- PubChem CID
- 104630
- DTXSID
DTXSID3068887- UNII
- KRG35B7CQJ
- EC Number
- 258-832-7
- Nikkaji
- J31.981C
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- FDA UNII
- 35 B7CQJ · KRG35B7CQJ
- EPA Substance Registry System
- 1 · 1-(Dibromomethyl)-3-phenoxybenzene (53874-67-2)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1-(dibromomethyl)-3-phenoxy-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
3 records
Compound notes
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