Basic information
- CAS
29969-23-1- Standard SMILES
Clc1cccc(OCCBr)c1Cl- InChIKey
VUTZYDRCILNUAC-UHFFFAOYSA-N- Molecular formula
- C8H7BrCl2O
- Average molar mass
- 269.95 g/mol
- Monoisotopic mass
- 267.90573
Names & identifiers
- Preferred name
- 1-(2-Bromoethoxy)-2,3-dichlorobenzene
- IUPAC
- 1-(2-bromoethoxy)-2,3-dichlorobenzene
- English name
- 1-(2-bromoethoxy)-2,3-dichlorobenzene
- Molecular formula
- C8H7BrCl2O
- Molecular weight
- 269.95
Names & synonyms
1-(2-Bromoethoxy)-2,3-dichlorobenzene29969-23-1SCHEMBL2206657VUTZYDRCILNUAC-UHFFFAOYSA-NAKOS000197448DB-161167Benzene, 1-(2-bromoethoxy)-2,3-dichloro-
Database identifiers
- CAS
29969-23-1- PubChem CID
- 23001076
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 134
Physicochemical properties
- Melting point
- 55.8 · 55.8-56.2 °C
- Boiling point
- 311.004 · 311.004±32.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.616 · 1.616±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Chemistry & industry
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
5 records
Compound notes
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