(5-prop-2-enyloxolan-2-yl)methanol

C8H14O2 — CID 74393488

IUPAC(5-prop-2-enyloxolan-2-yl)methanol
SMILESC=CCC1CCC(CO)O1
InChIInChI=1S/C8H14O2/c1-2-3-7-4-5-8(6-9)10-7/h2,7-9H,1,3-6H2
InChIKeySYMLTDCWUUNTQG-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.10
Rot. Bonds3

About (5-prop-2-enyloxolan-2-yl)methanol

(5-prop-2-enyloxolan-2-yl)methanol (PubChem CID 74393488) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (5-prop-2-enyloxolan-2-yl)methanol.

Molecular Properties

Compound Name(5-prop-2-enyloxolan-2-yl)methanol
PubChem CID74393488
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(5-prop-2-enyloxolan-2-yl)methanol
SMILESC=CCC1CCC(CO)O1
InChIInChI=1S/C8H14O2/c1-2-3-7-4-5-8(6-9)10-7/h2,7-9H,1,3-6H2
InChIKeySYMLTDCWUUNTQG-UHFFFAOYSA-N
XLogP1.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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 (5-prop-2-enyloxolan-2-yl)methanol?
The IUPAC name of (5-prop-2-enyloxolan-2-yl)methanol (CID 74393488) is (5-prop-2-enyloxolan-2-yl)methanol.
What is the SMILES notation for (5-prop-2-enyloxolan-2-yl)methanol?
The canonical SMILES for (5-prop-2-enyloxolan-2-yl)methanol is C=CCC1CCC(CO)O1.
What is the InChIKey of (5-prop-2-enyloxolan-2-yl)methanol?
The InChIKey is SYMLTDCWUUNTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-3-7-4-5-8(6-9)10-7/h2,7-9H,1,3-6H2.
What are the key properties of (5-prop-2-enyloxolan-2-yl)methanol?
(5-prop-2-enyloxolan-2-yl)methanol has a molecular weight of 142.20 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-prop-2-enyloxolan-2-yl)methanol is sourced from PubChem (CID 74393488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).