[(2S,6R)-6-ethenyloxan-2-yl]methanol

C8H14O2 — CID 130928084

IUPAC[(2S,6R)-6-ethenyloxan-2-yl]methanol
SMILESC=C[C@H]1CCC[C@@H](CO)O1
InChIInChI=1S/C8H14O2/c1-2-7-4-3-5-8(6-9)10-7/h2,7-9H,1,3-6H2/t7-,8-/m0/s1
InChIKeyMNWSMBLVQXOHNO-YUMQZZPRSA-N
MW142.20 g/mol
LogP1.10
Rot. Bonds2

About [(2S,6R)-6-ethenyloxan-2-yl]methanol

[(2S,6R)-6-ethenyloxan-2-yl]methanol (PubChem CID 130928084) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is [(2S,6R)-6-ethenyloxan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6R)-6-ethenyloxan-2-yl]methanol
PubChem CID130928084
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name[(2S,6R)-6-ethenyloxan-2-yl]methanol
SMILESC=C[C@H]1CCC[C@@H](CO)O1
InChIInChI=1S/C8H14O2/c1-2-7-4-3-5-8(6-9)10-7/h2,7-9H,1,3-6H2/t7-,8-/m0/s1
InChIKeyMNWSMBLVQXOHNO-YUMQZZPRSA-N
XLogP1.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2S,6R)-6-ethenyloxan-2-yl]methanol?
The IUPAC name of [(2S,6R)-6-ethenyloxan-2-yl]methanol (CID 130928084) is [(2S,6R)-6-ethenyloxan-2-yl]methanol.
What is the SMILES notation for [(2S,6R)-6-ethenyloxan-2-yl]methanol?
The canonical SMILES for [(2S,6R)-6-ethenyloxan-2-yl]methanol is C=C[C@H]1CCC[C@@H](CO)O1.
What is the InChIKey of [(2S,6R)-6-ethenyloxan-2-yl]methanol?
The InChIKey is MNWSMBLVQXOHNO-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-7-4-3-5-8(6-9)10-7/h2,7-9H,1,3-6H2/t7-,8-/m0/s1.
What are the key properties of [(2S,6R)-6-ethenyloxan-2-yl]methanol?
[(2S,6R)-6-ethenyloxan-2-yl]methanol has a molecular weight of 142.20 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6R)-6-ethenyloxan-2-yl]methanol is sourced from PubChem (CID 130928084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).