1-(1-methylcyclobutyl)oxypropan-2-ol

C8H16O2 — CID 142712437

IUPAC1-(1-methylcyclobutyl)oxypropan-2-ol
SMILESCC(O)COC1(C)CCC1
InChIInChI=1S/C8H16O2/c1-7(9)6-10-8(2)4-3-5-8/h7,9H,3-6H2,1-2H3
InChIKeySRSWUCZWPDTIAG-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.33
Rot. Bonds3

About 1-(1-methylcyclobutyl)oxypropan-2-ol

1-(1-methylcyclobutyl)oxypropan-2-ol (PubChem CID 142712437) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 1-(1-methylcyclobutyl)oxypropan-2-ol.

Molecular Properties

Compound Name1-(1-methylcyclobutyl)oxypropan-2-ol
PubChem CID142712437
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name1-(1-methylcyclobutyl)oxypropan-2-ol
SMILESCC(O)COC1(C)CCC1
InChIInChI=1S/C8H16O2/c1-7(9)6-10-8(2)4-3-5-8/h7,9H,3-6H2,1-2H3
InChIKeySRSWUCZWPDTIAG-UHFFFAOYSA-N
XLogP1.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Rac-(1s,3s)-3-[2-(tert-butoxy)ethoxy]cyclobutan-1-ol
CID 112590640
1-(2-(1,1-Dimethylethoxy)-1-methylethoxy)-2-propanol
CID 11321436
(2R)-1-[(2-methylpropan-2-yl)oxy]butan-2-ol
CID 89530548
1-(1,3-Dimethylbutoxy)-2-propanol
CID 41053
(1R,2R,3R)-2-Methoxy-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-ol
CID 155858890
Propylene glycol methyl-n-butyl ether
CID 21958013
Diethyl diethylene glycol
CID 22507180
Ethanol=diisopropyl ether
CID 129800676
1-Butoxy-3-tert-butyl-2-propanol
CID 142636
1-[(2-Methylpropan-2-yl)oxy]butan-2-ol
CID 11829590
1-[2-[(2-Methylpropan-2-yl)oxy]propoxy]propan-2-ol
CID 16217448
(2S)-1-tert-Butoxybutan-2-ol
CID 89530547

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclobutyl)oxypropan-2-ol?
The IUPAC name of 1-(1-methylcyclobutyl)oxypropan-2-ol (CID 142712437) is 1-(1-methylcyclobutyl)oxypropan-2-ol.
What is the SMILES notation for 1-(1-methylcyclobutyl)oxypropan-2-ol?
The canonical SMILES for 1-(1-methylcyclobutyl)oxypropan-2-ol is CC(O)COC1(C)CCC1.
What is the InChIKey of 1-(1-methylcyclobutyl)oxypropan-2-ol?
The InChIKey is SRSWUCZWPDTIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(9)6-10-8(2)4-3-5-8/h7,9H,3-6H2,1-2H3.
What are the key properties of 1-(1-methylcyclobutyl)oxypropan-2-ol?
1-(1-methylcyclobutyl)oxypropan-2-ol has a molecular weight of 144.21 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclobutyl)oxypropan-2-ol is sourced from PubChem (CID 142712437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).