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Basic information
- CAS
4580-43-2- Standard SMILES
C#CCCCCCC#CCCCCCC#C- InChIKey
FQMIMRQHPBBFQF-UHFFFAOYSA-N- Molecular formula
- C16H22
- Average molar mass
- 214.35 g/mol
- Monoisotopic mass
- 214.1721507
Names & identifiers
- Preferred name
- 1,8,15-Hexadecatriyne
- IUPAC
- hexadeca-1,8,15-triyne
- English name
- 1,8,15-Hexadecatriyne
- Molecular formula
- C16H22
- Molecular weight
- 214.35
Names & synonyms
1,8,15-Hexadecatriyne4580-43-2hexadeca-1,8,15-triyneDTXSID50196624
Database identifiers
- CAS
4580-43-2- PubChem CID
- 138299
- DTXSID
DTXSID50196624
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
Physicochemical properties
- Boiling point
- 110 · 110-115 °C(Press: 0.7 Torr)
- Density
- 0.88 · 0.880±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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