4-methylidene-2,3-dihydropyran

C6H8O — CID 22338748

IUPAC4-methylidene-2,3-dihydropyran
SMILESC=C1C=COCC1
InChIInChI=1S/C6H8O/c1-6-2-4-7-5-3-6/h2,4H,1,3,5H2
InChIKeyAJUQPFTZKLDLTL-UHFFFAOYSA-N
MW96.13 g/mol
LogP1.48
Rot. Bonds

About 4-methylidene-2,3-dihydropyran

4-methylidene-2,3-dihydropyran (PubChem CID 22338748) has the molecular formula C6H8O and a molecular weight of 96.13 g/mol. Its IUPAC name is 4-methylidene-2,3-dihydropyran.

Molecular Properties

Compound Name4-methylidene-2,3-dihydropyran
PubChem CID22338748
Molecular FormulaC6H8O
Molecular Weight96.13 g/mol
Exact Mass96.06
IUPAC Name4-methylidene-2,3-dihydropyran
SMILESC=C1C=COCC1
InChIInChI=1S/C6H8O/c1-6-2-4-7-5-3-6/h2,4H,1,3,5H2
InChIKeyAJUQPFTZKLDLTL-UHFFFAOYSA-N
XLogP1.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methylidene-2,3-dihydropyran?
The IUPAC name of 4-methylidene-2,3-dihydropyran (CID 22338748) is 4-methylidene-2,3-dihydropyran.
What is the SMILES notation for 4-methylidene-2,3-dihydropyran?
The canonical SMILES for 4-methylidene-2,3-dihydropyran is C=C1C=COCC1.
What is the InChIKey of 4-methylidene-2,3-dihydropyran?
The InChIKey is AJUQPFTZKLDLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O/c1-6-2-4-7-5-3-6/h2,4H,1,3,5H2.
What are the key properties of 4-methylidene-2,3-dihydropyran?
4-methylidene-2,3-dihydropyran has a molecular weight of 96.13 g/mol, XLogP of 1.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-2,3-dihydropyran is sourced from PubChem (CID 22338748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).