(3-ethyloxolan-2-yl)methanol

C7H14O2 — CID 139662526

IUPAC(3-ethyloxolan-2-yl)methanol
SMILESCCC1CCOC1CO
InChIInChI=1S/C7H14O2/c1-2-6-3-4-9-7(6)5-8/h6-8H,2-5H2,1H3
InChIKeyXHZWPGOJCPLONR-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.79
Rot. Bonds2

About (3-ethyloxolan-2-yl)methanol

(3-ethyloxolan-2-yl)methanol (PubChem CID 139662526) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is (3-ethyloxolan-2-yl)methanol.

Molecular Properties

Compound Name(3-ethyloxolan-2-yl)methanol
PubChem CID139662526
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name(3-ethyloxolan-2-yl)methanol
SMILESCCC1CCOC1CO
InChIInChI=1S/C7H14O2/c1-2-6-3-4-9-7(6)5-8/h6-8H,2-5H2,1H3
InChIKeyXHZWPGOJCPLONR-UHFFFAOYSA-N
XLogP0.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-2-(2-methylpropyl)oxolane
CID 177048891
(2S,3R)-2-(hydroxymethyl)oxolan-3-ol
CID 21120394
2-(hydroxymethyl)oxolan-3-ol;methanethiol
CID 172622049
(2S,3S)-2-ethyloxolan-3-amine
CID 124511863
(2S,3S,4R)-2-(hydroxymethyl)-3-methyloxan-4-ol
CID 89257792
2-(hydroxymethyl)oxane-3,4-diol;methanol
CID 144507531
(3S)-2-(hydroxymethyl)-3-methyloxan-4-ol
CID 153374722
(2R,3S)-3-ethyl-2-[(4-methylphenyl)methyl]oxolane
CID 11481131
[(1R,2R)-2-ethylcyclohexyl]methanol
CID 58154483
(2S)-2-ethyloxolane-3-thiol;methanol
CID 142092123
[(2S)-3-hydroperoxyoxolan-2-yl]methanol
CID 142984914
(2S,3R)-3-ethyl-2-methoxyoxolane
CID 142222546

Frequently Asked Questions

What is the IUPAC name of (3-ethyloxolan-2-yl)methanol?
The IUPAC name of (3-ethyloxolan-2-yl)methanol (CID 139662526) is (3-ethyloxolan-2-yl)methanol.
What is the SMILES notation for (3-ethyloxolan-2-yl)methanol?
The canonical SMILES for (3-ethyloxolan-2-yl)methanol is CCC1CCOC1CO.
What is the InChIKey of (3-ethyloxolan-2-yl)methanol?
The InChIKey is XHZWPGOJCPLONR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-2-6-3-4-9-7(6)5-8/h6-8H,2-5H2,1H3.
What are the key properties of (3-ethyloxolan-2-yl)methanol?
(3-ethyloxolan-2-yl)methanol has a molecular weight of 130.19 g/mol, XLogP of 0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyloxolan-2-yl)methanol is sourced from PubChem (CID 139662526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).