1-(3,4-dihydro-2H-pyran-6-yl)ethenol

C7H10O2 — CID 101235148

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)ethenol
SMILESC=C(O)C1=CCCCO1
InChIInChI=1S/C7H10O2/c1-6(8)7-4-2-3-5-9-7/h4,8H,1-3,5H2
InChIKeyOUDISQZFQJOOBA-UHFFFAOYSA-N
MW126.15 g/mol
LogP1.75
Rot. Bonds1

About 1-(3,4-dihydro-2H-pyran-6-yl)ethenol

1-(3,4-dihydro-2H-pyran-6-yl)ethenol (PubChem CID 101235148) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)ethenol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)ethenol
PubChem CID101235148
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)ethenol
SMILESC=C(O)C1=CCCCO1
InChIInChI=1S/C7H10O2/c1-6(8)7-4-2-3-5-9-7/h4,8H,1-3,5H2
InChIKeyOUDISQZFQJOOBA-UHFFFAOYSA-N
XLogP1.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)ethenol?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)ethenol (CID 101235148) is 1-(3,4-dihydro-2H-pyran-6-yl)ethenol.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)ethenol?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)ethenol is C=C(O)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)ethenol?
The InChIKey is OUDISQZFQJOOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-6(8)7-4-2-3-5-9-7/h4,8H,1-3,5H2.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)ethenol?
1-(3,4-dihydro-2H-pyran-6-yl)ethenol has a molecular weight of 126.15 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)ethenol is sourced from PubChem (CID 101235148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).