[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate

C8H12O3 — CID 10909812

IUPAC[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate
SMILESCC(=O)OC[C@H]1CCC=CO1
InChIInChI=1S/C8H12O3/c1-7(9)11-6-8-4-2-3-5-10-8/h3,5,8H,2,4,6H2,1H3/t8-/m1/s1
InChIKeyUVVZLQHUDLXMGT-MRVPVSSYSA-N
MW156.18 g/mol
LogP1.24
Rot. Bonds2

About [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate

[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate (PubChem CID 10909812) has the molecular formula C8H12O3 and a molecular weight of 156.18 g/mol. Its IUPAC name is [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate.

Molecular Properties

Compound Name[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate
PubChem CID10909812
Molecular FormulaC8H12O3
Molecular Weight156.18 g/mol
Exact Mass156.08
IUPAC Name[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate
SMILESCC(=O)OC[C@H]1CCC=CO1
InChIInChI=1S/C8H12O3/c1-7(9)11-6-8-4-2-3-5-10-8/h3,5,8H,2,4,6H2,1H3/t8-/m1/s1
InChIKeyUVVZLQHUDLXMGT-MRVPVSSYSA-N
XLogP1.24
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The IUPAC name of [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate (CID 10909812) is [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate.
What is the SMILES notation for [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The canonical SMILES for [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate is CC(=O)OC[C@H]1CCC=CO1.
What is the InChIKey of [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The InChIKey is UVVZLQHUDLXMGT-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H12O3/c1-7(9)11-6-8-4-2-3-5-10-8/h3,5,8H,2,4,6H2,1H3/t8-/m1/s1.
What are the key properties of [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate has a molecular weight of 156.18 g/mol, XLogP of 1.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-3,4-dihydro-2H-pyran-2-yl]methyl acetate is sourced from PubChem (CID 10909812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).