(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde

C7H10O2 — CID 5325609

IUPAC(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
SMILESCC1=CCO[C@@H](C=O)C1
InChIInChI=1S/C7H10O2/c1-6-2-3-9-7(4-6)5-8/h2,5,7H,3-4H2,1H3/t7-/m1/s1
InChIKeyXVOBRVYBCPPREW-SSDOTTSWSA-N
MW126.15 g/mol
LogP0.92
Rot. Bonds1

About (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde

(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde (PubChem CID 5325609) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde.

Molecular Properties

Compound Name(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
PubChem CID5325609
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
SMILESCC1=CCO[C@@H](C=O)C1
InChIInChI=1S/C7H10O2/c1-6-2-3-9-7(4-6)5-8/h2,5,7H,3-4H2,1H3/t7-/m1/s1
InChIKeyXVOBRVYBCPPREW-SSDOTTSWSA-N
XLogP0.92
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
CID 11018871
4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
CID 21627998
1-[(2R,6R)-6-ethyl-5-methyl-3,6-dihydro-2H-pyran-2-yl]ethanone
CID 11182856
(2s)-4-Methyl-6-oxo-3,6-dihydro-2h-pyran-2-carbaldehyde
CID 134823980
(E)-5-[(2R,6R)-6-ethyl-5-methyl-3,6-dihydro-2H-pyran-2-yl]hex-4-enal
CID 134987735
3,6-Dihydro-2H-pyran-2-carboxaldehyde
CID 19778718
3,6-dimethyl-3,6-dihydro-2H-pyran-2-carbaldehyde
CID 20059539
1-(5-methyl-3,6-dihydro-2H-pyran-2-yl)ethanone
CID 21986131
6-methoxy-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde
CID 23338793
2-(5-methyl-3,6-dihydro-2H-pyran-2-yl)acetaldehyde
CID 23549514
(2R)-4-methyl-6-oxo-2,3-dihydropyran-2-carbaldehyde
CID 60061892
2,5-dimethyl-3,6-dihydro-2H-pyran-6-carbaldehyde
CID 88528804

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde?
The IUPAC name of (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde (CID 5325609) is (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde.
What is the SMILES notation for (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde?
The canonical SMILES for (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde is CC1=CCO[C@@H](C=O)C1.
What is the InChIKey of (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde?
The InChIKey is XVOBRVYBCPPREW-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H10O2/c1-6-2-3-9-7(4-6)5-8/h2,5,7H,3-4H2,1H3/t7-/m1/s1.
What are the key properties of (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde?
(2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde has a molecular weight of 126.15 g/mol, XLogP of 0.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-3,6-dihydro-2H-pyran-2-carbaldehyde is sourced from PubChem (CID 5325609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).