Basic information
- CAS
35282-97-4- Standard SMILES
CCOC(=O)C(Br)C(Br)c1ccc(Cl)cc1- InChIKey
AWXVWHGHUTUGAK-UHFFFAOYSA-N- Molecular formula
- C11H11Br2ClO2
- Average molar mass
- 370.46 g/mol
- Monoisotopic mass
- 367.88143
Names & identifiers
- Preferred name
- Ethyl 2,3-dibromo-3-(4-chlorophenyl)propanoate
- IUPAC
- ethyl 2,3-dibromo-3-(4-chlorophenyl)propanoate
- English name
- Benzenepropanoic acid, .alpha.,.beta.-dibroMo-4-chloro-, ethyl e
- Molecular formula
- C11H11Br2ClO2
- Molecular weight
- 370.46
Names & synonyms
ethyl 2,3-dibromo-3-(4-chlorophenyl)propanoate35282-97-4NSC89330SCHEMBL31198053DTXSID90293409NSC-89330Benzenepropanoic acid, α,β-dibromo-4-chloro-, ethyl esterBenzenepropanoic acid, .alpha.,.beta.-dibroMo-4-chloro-, ethyl eBenzenepropanoic acid, .alpha.,.beta.-dibroMo-4-chloro-, ethyl ester
Database identifiers
- CAS
35282-97-4- PubChem CID
- 259403
- DTXSID
DTXSID90293409
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- Boiling point
- 350.429 · 350.429±37.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.726 · 1.726±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
上海百韧生物科技有限公司13564638271 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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