Basic information
- CAS
832744-28-2- Standard SMILES
Clc1ccc(C#Cc2ccc(Br)cc2)cc1- InChIKey
GOVDQARNNMIPTP-UHFFFAOYSA-N- Molecular formula
- C14H8BrCl
- Average molar mass
- 291.57 g/mol
- Monoisotopic mass
- 289.94979004
Names & identifiers
- Preferred name
- 1-Bromo-4-[(4-chlorophenyl)ethynyl]benzene
- IUPAC
- 1-bromo-4-[2-(4-chlorophenyl)ethynyl]benzene
- English name
- 1-Bromo-4-[(4-chlorophenyl)ethynyl]benzene
- Molecular formula
- C14H8BrCl
- Molecular weight
- 0
Names & synonyms
832744-28-21-Bromo-4-[(4-chlorophenyl)ethynyl]benzeneBenzene, 1-bromo-4-[(4-chlorophenyl)ethynyl]-SCHEMBL4461464DTXSID50727033GOVDQARNNMIPTP-UHFFFAOYSA-NDB-3119571-bromo4-[(4-chlorophenyl) ethynyl] benzene1-bromo-4-[(4-chlorophenyl) ethynyl] benzene1-bromo-4-[2-(4-chlorophenyl)ethynyl]benzene
Database identifiers
- CAS
832744-28-2- PubChem CID
- 57530615
- DTXSID
DTXSID50727033- Nikkaji
- J3.023.377H
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 272
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
4 records
Compound notes
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