[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol

C8H12O3 — CID 141007678

IUPAC[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol
SMILESCC1(C2(CO)CC2)OC=CO1
InChIInChI=1S/C8H12O3/c1-7(10-4-5-11-7)8(6-9)2-3-8/h4-5,9H,2-3,6H2,1H3
InChIKeyQVFLLMMGCDFNJY-UHFFFAOYSA-N
MW156.18 g/mol
LogP0.99
Rot. Bonds2

About [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol

[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol (PubChem CID 141007678) has the molecular formula C8H12O3 and a molecular weight of 156.18 g/mol. Its IUPAC name is [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol
PubChem CID141007678
Molecular FormulaC8H12O3
Molecular Weight156.18 g/mol
Exact Mass156.08
IUPAC Name[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol
SMILESCC1(C2(CO)CC2)OC=CO1
InChIInChI=1S/C8H12O3/c1-7(10-4-5-11-7)8(6-9)2-3-8/h4-5,9H,2-3,6H2,1H3
InChIKeyQVFLLMMGCDFNJY-UHFFFAOYSA-N
XLogP0.99
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-propylcyclopropyl)methanol
CID 66026334
[4,4-dimethyl-1-(oxiran-2-ylmethyl)cyclohexyl]methanol
CID 165442527
3-[1-(2-butyl-1,3-dioxol-2-yl)cyclopropyl]propan-1-ol
CID 141007685
[1-(chloromethyl)cyclopropyl]methanol
CID 12920386
[4-(1,3-dioxol-2-yl)-1-methylcyclohexyl]methanol
CID 168866006
(1-methylcyclododecyl)methanol
CID 70130772
[1-[2-(dimethylamino)ethyl]cyclopropyl]methanol
CID 130950587
[3-(hydroxymethyl)-2,4-dihydropyran-3-yl]methanol
CID 169291221
ethane;(4-ethyloxan-4-yl)methanol
CID 143573647
[1-[(4-ethylphenyl)methyl]cyclopropyl]methanol
CID 66025212
1-[1-(hydroxymethyl)cyclopropyl]cyclopentan-1-ol
CID 165442160
[1-[1-(hydroxymethyl)cycloundecyl]cycloundecyl]methanol
CID 22328250

Frequently Asked Questions

What is the IUPAC name of [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol?
The IUPAC name of [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol (CID 141007678) is [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol.
What is the SMILES notation for [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol?
The canonical SMILES for [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol is CC1(C2(CO)CC2)OC=CO1.
What is the InChIKey of [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol?
The InChIKey is QVFLLMMGCDFNJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O3/c1-7(10-4-5-11-7)8(6-9)2-3-8/h4-5,9H,2-3,6H2,1H3.
What are the key properties of [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol?
[1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol has a molecular weight of 156.18 g/mol, XLogP of 0.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methyl-1,3-dioxol-2-yl)cyclopropyl]methanol is sourced from PubChem (CID 141007678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).