5-Phenylpenta-1,3-diynylbenzene
Basic information
- CAS
6088-99-9- Standard SMILES
C(C#Cc1ccccc1)#CCc1ccccc1- InChIKey
AFAXUPJQEIQWKO-UHFFFAOYSA-N- Molecular formula
- C17H12
- Average molar mass
- 216.28 g/mol
- Monoisotopic mass
- 216.09390038
Names & identifiers
- Preferred name
- 5-Phenylpenta-1,3-diynylbenzene
- IUPAC
- 5-phenylpenta-1,3-diynylbenzene
Names & synonyms
6088-99-9NSC89015DTXSID00976357NSC-890151,1'-(Penta-1,3-diyne-1,5-diyl)dibenzene
Database identifiers
- CAS
6088-99-9- PubChem CID
- 259277
- DTXSID
DTXSID00976357- Nikkaji
- J2.159.735J
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…