Basic information
- CAS
153026-72-3- Standard SMILES
C#Cc1ccc(C(O)C#C)o1- InChIKey
LJYSFGXNVQWINP-UHFFFAOYSA-N- Molecular formula
- C9H6O2
- Average molar mass
- 146.14 g/mol
- Monoisotopic mass
- 146.03677943
Names & identifiers
- Preferred name
- I+/-,5-Diethynyl-2-furanmethanol
- IUPAC
- 1-(5-ethynylfuran-2-yl)prop-2-yn-1-ol
Names & synonyms
SCHEMBL9223618DTXSID101308125I+/-,5-Diethynyl-2-furanmethanol1-(5-ethynylfuran-2-yl)prop-2-yn-1-ol153026-72-3
Database identifiers
- CAS
153026-72-3- PubChem CID
- 20079679
- DTXSID
DTXSID101308125
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 33.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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