5,6-Dihydro-alpha-(phenylmethyl)-2H-pyran-3-methanol
Basic information
- CAS
16891-80-8- Standard SMILES
OC(Cc1ccccc1)C1=CCCOC1- InChIKey
RQCMEGSOOZSUIE-UHFFFAOYSA-N- Molecular formula
- C13H16O2
- Average molar mass
- 204.26 g/mol
- Monoisotopic mass
- 204.11502975
Overview
structure
Names & identifiers
- Preferred name
- 5,6-Dihydro-alpha-(phenylmethyl)-2H-pyran-3-methanol
- IUPAC
- 1-(3,6-dihydro-2H-pyran-5-yl)-2-phenylethanol
- English name
- alpha-benzyl-5,6-dihydro-2H-pyran-3-methanol
- Molecular formula
- C13H16O2
- Molecular weight
- 204.26
Names & synonyms
16891-80-8Vedrenanalpha-Benzyl-5,6-dihydro-2H-pyran-3-methanol1IW3C60J1K1-(5,6-dihydropyran-3-yl)-2-phenylethanol5,6-Dihydro-alpha-(phenylmethyl)-2H-pyran-3-methanolRefChem:193889240-928-51-(3,6-dihydro-2H-pyran-5-yl)-2-phenylethanol1-(5,6-dihydro-2H-pyran-3-yl)-2-phenylethanol1-(5,6-Dihydro-2H-pyran-3-yl)-2-phenylethan-1-olEINECS 240-928-5
Show more names
5,6-Dihydro-α-phenylmethyl-2H-pyran-3-methanol2H-Pyran-3-methanol, 5,6-dihydro-α-(phenylmethyl)-
UNII-1IW3C60J1KDTXSID00937564NS000519001-(5,6-DIHYDRO-3-PYRANYL)-2-PHENYLETHANOL.ALPHA.-BENZYL-5,6-DIHYDRO-2H-PYRAN-3-METHANOL1-(5,6-DIHYDRO-3-PYRANYL)-2-PHENYL-1-ETHANOLBENZYL-5,6-DIHYDRO-2H-PYRAN-3-METHANOL, ALPHA2H-PYRAN-3-METHANOL, .ALPHA.-BENZYL-5,6-DIHYDRO-
Database identifiers
- CAS
16891-80-8- PubChem CID
- 86089
- DTXSID
DTXSID00937564- UNII
- 1IW3C60J1K
- EC Number
- 240-928-5
- Nikkaji
- J236.892G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- FDA UNII
- 1 IW3C60J1K · 1IW3C60J1K
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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