Benzene, 1,4-bis(iodoethynyl)-
Basic information
- CAS
878-06-8- Standard SMILES
IC#Cc1ccc(C#CI)cc1- InChIKey
KONPNFFXVBGRMH-UHFFFAOYSA-N- Molecular formula
- C10H4I2
- Average molar mass
- 377.95 g/mol
- Monoisotopic mass
- 377.84025
Names & identifiers
- Preferred name
- Benzene, 1,4-bis(iodoethynyl)-
- IUPAC
- 1,4-bis(2-iodoethynyl)benzene
Names & synonyms
Benzene, 1,4-bis(iodoethynyl)-DTXSID20406661878-06-8RefChem:323387DTXCID703575131,4-Bis(iodoethynyl)benzeneSCHEMBL5484562[1,4-bis(iodo-ethynyl)benzene]
Database identifiers
- CAS
878-06-8- PubChem CID
- 4867461
- DTXSID
DTXSID20406661- Nikkaji
- J1.220.811A
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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