4H-Pyran, 4-methyl-
Basic information
- CAS
16855-95-1- Standard SMILES
CC1C=COC=C1- InChIKey
SIPORUXLFVLCBQ-UHFFFAOYSA-N- Molecular formula
- C6H8O
- Average molar mass
- 96.13 g/mol
- Monoisotopic mass
- 96.05751487
Names & identifiers
- Preferred name
- 4H-Pyran, 4-methyl-
- IUPAC
- 4-methyl-4H-pyran
Names & synonyms
4H-Pyran, 4-methyl-16855-95-14-methyl-4H-pyranSCHEMBL10677407SCHEMBL10677414DTXSID60168579
Database identifiers
- CAS
16855-95-1- PubChem CID
- 140147
- DTXSID
DTXSID60168579
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 90.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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