Basic information
- CAS
40924-58-1- Standard SMILES
C#CCC#CCOC1CCCCO1- InChIKey
WABDBBMWUMFVFW-UHFFFAOYSA-N- Molecular formula
- C11H14O2
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.09937969
Names & identifiers
- Preferred name
- 2-(2,5-Hexadiynyloxy)tetrahydro-2H-pyran
- IUPAC
- 2-hexa-2,5-diynoxyoxane
- English name
- 2-(2,5-Hexadiynyloxy)tetrahydro-2H-pyran
- Molecular formula
- C11H14O2
- Molecular weight
- 178.23
Names & synonyms
2-(2,5-Hexadiynyloxy)tetrahydro-2H-pyran40924-58-1DTXSID90336481RefChem:250220DTXCID402875702H-Pyran, 2-(2,5-hexadiynyloxy)tetrahydro-SCHEMBL105786932-[(Hexa-2,5-diyn-1-yl)oxy]oxanehexa-2,5-diyn-1-ol tetrahydropyranyl ether2-(2,5-Hexadiynyloxy)tetrahydro-2H-pyran #tetrahydro-2-(2,5-hexadiynyloxy)-2H-pyrane2H-Pyran, 2-(2,5-hexadiyn-1-yloxy)tetrahydro-
Database identifiers
- CAS
40924-58-1- PubChem CID
- 534025
- DTXSID
DTXSID90336481- Nikkaji
- J110.847F
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- Boiling point
- 62 · 62-72 °C(Press: 0.001 Torr)
- Density
- 1.02 · 1.02±0.1 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
东阳市求索医药科技有限公司17502510579 · [email protected]
Related reactions
3 records
Compound notes
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