2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran

C9H16O — CID 20651676

IUPAC2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran
SMILESCC1=CC(C)C(C)C(C)O1
InChIInChI=1S/C9H16O/c1-6-5-7(2)10-9(4)8(6)3/h5-6,8-9H,1-4H3
InChIKeySNULREISYKMWAD-UHFFFAOYSA-N
MW140.23 g/mol
LogP2.58
Rot. Bonds

About 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran

2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran (PubChem CID 20651676) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran
PubChem CID20651676
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran
SMILESCC1=CC(C)C(C)C(C)O1
InChIInChI=1S/C9H16O/c1-6-5-7(2)10-9(4)8(6)3/h5-6,8-9H,1-4H3
InChIKeySNULREISYKMWAD-UHFFFAOYSA-N
XLogP2.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran?
The IUPAC name of 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran (CID 20651676) is 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran?
The canonical SMILES for 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran is CC1=CC(C)C(C)C(C)O1.
What is the InChIKey of 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran?
The InChIKey is SNULREISYKMWAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-6-5-7(2)10-9(4)8(6)3/h5-6,8-9H,1-4H3.
What are the key properties of 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran?
2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran has a molecular weight of 140.23 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,6-tetramethyl-3,4-dihydro-2H-pyran is sourced from PubChem (CID 20651676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).