1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol

C10H18O2 — CID 20975834

IUPAC1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol
SMILESC=CC1(C)CCC(CC(C)O)O1
InChIInChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)7-8(2)11/h4,8-9,11H,1,5-7H2,2-3H3
InChIKeyABSFZESJWCDFTD-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.88
Rot. Bonds3

About 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol

1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol (PubChem CID 20975834) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol
PubChem CID20975834
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol
SMILESC=CC1(C)CCC(CC(C)O)O1
InChIInChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)7-8(2)11/h4,8-9,11H,1,5-7H2,2-3H3
InChIKeyABSFZESJWCDFTD-UHFFFAOYSA-N
XLogP1.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 526973
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CID 529918
3-(5-Methyl-5-vinyltetrahydrofuran-2-yl)butan-2-ol
CID 75094173
(2S,3R,5R)-2-ethenyl-5-methyl-5-propyloxolan-3-ol
CID 11571865
(2S,3R,5S)-2-ethenyl-5-methyl-5-propyloxolan-3-ol
CID 16220344
(3R)-3-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]butan-2-ol
CID 45113877
[(2R,3S,4S)-2-ethenyl-4-pentyloxetan-3-yl]methanol
CID 101718399
(2R)-2-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]-6-methylhept-5-en-3-ol
CID 134833061
(2R)-2-[(2S,5R)-5-ethenyl-5-methyloxolan-2-yl]-4,4-dimethylhex-5-en-3-ol
CID 134861453
(1R)-1-[(2R,3R)-2-ethenyloxetan-3-yl]hexan-1-ol
CID 134992771
1-[(2R,4S)-2-ethenyl-4-methyloxetan-3-yl]hexan-1-ol
CID 138974803

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol?
The IUPAC name of 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol (CID 20975834) is 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol.
What is the SMILES notation for 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol?
The canonical SMILES for 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol is C=CC1(C)CCC(CC(C)O)O1.
What is the InChIKey of 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol?
The InChIKey is ABSFZESJWCDFTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-4-10(3)6-5-9(12-10)7-8(2)11/h4,8-9,11H,1,5-7H2,2-3H3.
What are the key properties of 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol?
1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol has a molecular weight of 170.25 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethenyl-5-methyloxolan-2-yl)propan-2-ol is sourced from PubChem (CID 20975834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).