Basic information
- CAS
958-79-2- Standard SMILES
O=C(C(Br)c1ccccc1)C(Br)c1ccccc1- InChIKey
AKVJDXBLRZFJFZ-UHFFFAOYSA-N- Molecular formula
- C15H12Br2O
- Average molar mass
- 368.06 g/mol
- Monoisotopic mass
- 365.92549
Names & identifiers
- Preferred name
- 2-Propanone, 1,3-dibromo-1,3-diphenyl-
- IUPAC
- 1,3-dibromo-1,3-diphenylpropan-2-one
- English name
- Nsc134966
- Molecular formula
- C15H12Br2O
- Molecular weight
- 368.06
Names & synonyms
958-79-22-Propanone, 1,3-dibromo-1,3-diphenyl-RefChem:10643061,3-Dibromo-1,3-diphenyl-2-propanone1,3-dibromo-1,3-diphenylpropan-2-onealpha,alpha'-Dibromodibenzylketonebis(bromobenzyl) ketoneSCHEMBL5820145DTXSID00914810AKVJDXBLRZFJFZ-UHFFFAOYSA-NNSC134966AKOS001483386
Show more names
AKOS021983210NSC 134966NSC-134966.alpha.,.alpha.'-Dibromobibenzyl ketone.alpha., .alpha.'-Dibromodibenzyl ketoneDS-013583I83844
Database identifiers
- CAS
958-79-2- PubChem CID
- 97594
- DTXSID
DTXSID00914810- Nikkaji
- J899.390D
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- Melting point
- 112 · 112-114 °C
- Boiling point
- 399.5 · 399.5±37.0 °C(Predicted)
- Density
- 1.639 · 1.639±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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