3-cyclopropyl-2,2-dimethyloxolan-3-ol

C9H16O2 — CID 126990500

IUPAC3-cyclopropyl-2,2-dimethyloxolan-3-ol
SMILESCC1(C)OCCC1(O)C1CC1
InChIInChI=1S/C9H16O2/c1-8(2)9(10,5-6-11-8)7-3-4-7/h7,10H,3-6H2,1-2H3
InChIKeyOUTZONGGCLMJOV-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.33
Rot. Bonds1

About 3-cyclopropyl-2,2-dimethyloxolan-3-ol

3-cyclopropyl-2,2-dimethyloxolan-3-ol (PubChem CID 126990500) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 3-cyclopropyl-2,2-dimethyloxolan-3-ol.

Molecular Properties

Compound Name3-cyclopropyl-2,2-dimethyloxolan-3-ol
PubChem CID126990500
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name3-cyclopropyl-2,2-dimethyloxolan-3-ol
SMILESCC1(C)OCCC1(O)C1CC1
InChIInChI=1S/C9H16O2/c1-8(2)9(10,5-6-11-8)7-3-4-7/h7,10H,3-6H2,1-2H3
InChIKeyOUTZONGGCLMJOV-UHFFFAOYSA-N
XLogP1.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-4-(4-methylcyclohexyl)oxan-4-ol
CID 64748775
2-cyclobutyloxetan-2-ol
CID 174975220
2,2,3,3,4-pentamethyloxane
CID 140691979
(3'aS,7'aR)-spiro[1,3-dioxolane-2,4'-2,3,5,6,7,7a-hexahydro-1H-indene]-3'a-ol
CID 100984466
1-cyclobutyl-2,2-dimethylcyclobutan-1-ol
CID 130554912
1-cyclopentyl-2,2-dimethylcyclobutan-1-ol
CID 130554936
4-cyclopropyl-8-oxaspiro[4.5]decan-4-ol
CID 130493942
2,2,6,6-tetramethyl-1,3-dioxocane
CID 100919422
4-hydroxy-2,2,4-trimethyloxan-3-one
CID 14977611
(3S)-2-methyloxolane-2,3-diol
CID 134855830
2-methyl-1-(oxan-4-yl)cyclobutan-1-ol
CID 130555054
(3aS,6aS)-3a,6a-dimethyl-2,3,5,6-tetrahydrofuro[3,2-b]furan
CID 144631542

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2,2-dimethyloxolan-3-ol?
The IUPAC name of 3-cyclopropyl-2,2-dimethyloxolan-3-ol (CID 126990500) is 3-cyclopropyl-2,2-dimethyloxolan-3-ol.
What is the SMILES notation for 3-cyclopropyl-2,2-dimethyloxolan-3-ol?
The canonical SMILES for 3-cyclopropyl-2,2-dimethyloxolan-3-ol is CC1(C)OCCC1(O)C1CC1.
What is the InChIKey of 3-cyclopropyl-2,2-dimethyloxolan-3-ol?
The InChIKey is OUTZONGGCLMJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-8(2)9(10,5-6-11-8)7-3-4-7/h7,10H,3-6H2,1-2H3.
What are the key properties of 3-cyclopropyl-2,2-dimethyloxolan-3-ol?
3-cyclopropyl-2,2-dimethyloxolan-3-ol has a molecular weight of 156.22 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2,2-dimethyloxolan-3-ol is sourced from PubChem (CID 126990500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).