Basic information
- Standard SMILES
O=C(/C=C/c1ccc(Br)cc1)c1ccc(Br)cc1- InChIKey
LRNSKEMAIABAKW-XCVCLJGOSA-N- Molecular formula
- C15H10Br2O
- Average molar mass
- 366.05 g/mol
- Monoisotopic mass
- 363.90983914
Names & identifiers
- Preferred name
- (2E)-1,3-Bis(4-bromophenyl)-2-propen-1-one
- IUPAC
- (E)-1,3-bis(4-bromophenyl)prop-2-en-1-one
- English name
- (E)-4,4'-Dibromochalcone
- Molecular formula
- C15H10Br2O
- Molecular weight
- 366.05
Names & synonyms
126443-21-8DTXSID201266300(2E)-1,3-Bis(4-bromophenyl)-2-propen-1-oneRefChem:1049746DTXCID601696949(E)-1,3-bis(4-bromophenyl)prop-2-en-1-one5471-96-5(2E)-1,3-bis(4-bromophenyl)prop-2-en-1-one1,3-Bis-(4-bromo-phenyl)-propenone1,3-bis-(4-bromophenyl)propenone1,3-bis(4-bromophenyl)prop-2-en-1-oneMFCD00443474
Show more names
(E)-4,4'-Dibromochalcone2-Propen-1-one, 1,3-bis(4-bromophenyl)-, (2E)-
NSC28481starbld00094102-Propen-1-one, 1,3-bis(4-bromophenyl)-SCHEMBL16598321,3-bis(4-bromophenyl)propenonep,p'-Dibrombenzyliden-acetophenonLRNSKEMAIABAKW-XCVCLJGOSA-NNSC-28481
Database identifiers
- CAS
126443-21-8、5471-96-5- PubChem CID
- 5293151
- DTXSID
DTXSID201266300- Nikkaji
- J1.276.109K、J151.075D
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- 184 · 184-185 °C
- Boiling point
- 450.6 · 450.6±45.0 °C(Predicted)
- Density
- 1.647 · 1.647±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers6 total
上海达立康医药科技有限公司18658316824
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
Loading…