(2-propan-2-yloxolan-2-yl)methanol

C8H16O2 — CID 130663266

IUPAC(2-propan-2-yloxolan-2-yl)methanol
SMILESCC(C)C1(CO)CCCO1
InChIInChI=1S/C8H16O2/c1-7(2)8(6-9)4-3-5-10-8/h7,9H,3-6H2,1-2H3
InChIKeyQSZBYJKPTVWUDR-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.18
Rot. Bonds2

About (2-propan-2-yloxolan-2-yl)methanol

(2-propan-2-yloxolan-2-yl)methanol (PubChem CID 130663266) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (2-propan-2-yloxolan-2-yl)methanol.

Molecular Properties

Compound Name(2-propan-2-yloxolan-2-yl)methanol
PubChem CID130663266
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(2-propan-2-yloxolan-2-yl)methanol
SMILESCC(C)C1(CO)CCCO1
InChIInChI=1S/C8H16O2/c1-7(2)8(6-9)4-3-5-10-8/h7,9H,3-6H2,1-2H3
InChIKeyQSZBYJKPTVWUDR-UHFFFAOYSA-N
XLogP1.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2S)-2-propan-2-yloxiran-2-yl]methanol
CID 130635963
ethane;2-ethyl-2-propan-2-yloxolane
CID 156888373
N-methyl-1-(2-propan-2-yloxan-2-yl)methanamine
CID 130624449
[2-(propan-2-ylamino)oxolan-2-yl]methanol
CID 146535477
2-butan-2-yl-2-(chloromethyl)oxolane
CID 126987650
2-(bromomethyl)-2-butan-2-yloxolane
CID 130692054
(2-butan-2-yloxolan-2-yl)methanamine
CID 126987670
(2R)-2-methyl-2-propan-2-yloxolane
CID 59911363
(7-methyl-3-propan-2-yl-1,4-dioxaspiro[4.5]decan-3-yl)methanol
CID 69471532
2-bromo-1,2-bis[2-(hydroxymethyl)oxetan-2-yl]ethanol
CID 129048700
N-methyl-2-propan-2-yloxolan-2-amine
CID 129253731
[2-[(1-methylcyclopentyl)methyl]oxolan-2-yl]methanol
CID 130609963

Frequently Asked Questions

What is the IUPAC name of (2-propan-2-yloxolan-2-yl)methanol?
The IUPAC name of (2-propan-2-yloxolan-2-yl)methanol (CID 130663266) is (2-propan-2-yloxolan-2-yl)methanol.
What is the SMILES notation for (2-propan-2-yloxolan-2-yl)methanol?
The canonical SMILES for (2-propan-2-yloxolan-2-yl)methanol is CC(C)C1(CO)CCCO1.
What is the InChIKey of (2-propan-2-yloxolan-2-yl)methanol?
The InChIKey is QSZBYJKPTVWUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(2)8(6-9)4-3-5-10-8/h7,9H,3-6H2,1-2H3.
What are the key properties of (2-propan-2-yloxolan-2-yl)methanol?
(2-propan-2-yloxolan-2-yl)methanol has a molecular weight of 144.21 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-yloxolan-2-yl)methanol is sourced from PubChem (CID 130663266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).