Basic information
- Standard SMILES
O=C(CBr)C(c1ccccc1)c1ccccc1- InChIKey
MXUDDMSHZFPMLF-UHFFFAOYSA-N- Molecular formula
- C15H13BrO
- Average molar mass
- 289.17 g/mol
- Monoisotopic mass
- 288.01497714
Names & identifiers
- Preferred name
- 3-Bromo-1,1-diphenylacetone
- IUPAC
- 3-bromo-1,1-diphenylpropan-2-one
- English name
- 3-Bromo-1,1-diphenylacetone
- Molecular formula
- C15H13BrO
- Molecular weight
- 289.17
Names & synonyms
3-bromo-1,1-diphenylacetone33609-25-53-bromo-1,1-diphenylpropan-2-oneSCHEMBL6335418DTXSID60383280MXUDDMSHZFPMLF-UHFFFAOYSA-N1-bromo-3,3-diphenyl-2-propanone3-Bromo-1,1-diphenyl-2-propanone1,1-diphenyl-3-bromo-propan-2-oneMFCD038221273-Bromo-1,1-diphenylacetone, 90+%2-Propanone, 3-bromo-1,1-diphenyl-
Database identifiers
- CAS
33609-25-5- PubChem CID
- 2794635
- DTXSID
DTXSID60383280
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- Melting point
- 64 °C · 64 °C
- Boiling point
- 364.9 · 364.9±27.0 °C(Predicted)
- Density
- 1.358 · 1.358±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers5 total
天津凯利奇生物科技有限公司15076683720 · [email protected]
Tianjin Xinshengjiahe Science & Technology Development Co,.Ltd+86-86-22-87899925 +86-8618522618860 · [email protected]
山东优阜药业科技有限公司536-8266195 +8613953676784 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
21 records
Linked notes
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