1-(5-methyloxolan-3-yl)propan-1-ol

C8H16O2 — CID 115787725

IUPAC1-(5-methyloxolan-3-yl)propan-1-ol
SMILESCCC(O)C1COC(C)C1
InChIInChI=1S/C8H16O2/c1-3-8(9)7-4-6(2)10-5-7/h6-9H,3-5H2,1-2H3
InChIKeyOADMMWZLJGDRRC-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.18
Rot. Bonds2

About 1-(5-methyloxolan-3-yl)propan-1-ol

1-(5-methyloxolan-3-yl)propan-1-ol (PubChem CID 115787725) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 1-(5-methyloxolan-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(5-methyloxolan-3-yl)propan-1-ol
PubChem CID115787725
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name1-(5-methyloxolan-3-yl)propan-1-ol
SMILESCCC(O)C1COC(C)C1
InChIInChI=1S/C8H16O2/c1-3-8(9)7-4-6(2)10-5-7/h6-9H,3-5H2,1-2H3
InChIKeyOADMMWZLJGDRRC-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

2-Ethyl-1,3-Hexanediol
CID 7211
3-((2-Ethylhexyl)oxy)-1,2-propanediol
CID 9859093
3-Methyl-2,4-heptanediol
CID 248872
1,4-Anhydro-2,5-dideoxy-1,1-diethylpentitol
CID 23195
(5-Methyloxolan-3-yl)methanol
CID 15278170
5-(Oxolan-2-ylmethyl)heptan-2-ol
CID 551274
5-Methylheptane-2,4-diol
CID 21648709
1,4-Anhydro-2,5-dideoxy-1-ethyl-1-methylpentitol
CID 34717
3,4-Furandiol, tetrahydro-2,2-diethyl-5-methyl-
CID 35968
2-(5,5-Dimethyloxolan-2-yl)ethan-1-ol
CID 11355541
(2-Methyloxolan-3-yl)methanol
CID 13487335
1-(Oxolan-3-yl)ethan-1-ol
CID 59594973

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyloxolan-3-yl)propan-1-ol?
The IUPAC name of 1-(5-methyloxolan-3-yl)propan-1-ol (CID 115787725) is 1-(5-methyloxolan-3-yl)propan-1-ol.
What is the SMILES notation for 1-(5-methyloxolan-3-yl)propan-1-ol?
The canonical SMILES for 1-(5-methyloxolan-3-yl)propan-1-ol is CCC(O)C1COC(C)C1.
What is the InChIKey of 1-(5-methyloxolan-3-yl)propan-1-ol?
The InChIKey is OADMMWZLJGDRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-3-8(9)7-4-6(2)10-5-7/h6-9H,3-5H2,1-2H3.
What are the key properties of 1-(5-methyloxolan-3-yl)propan-1-ol?
1-(5-methyloxolan-3-yl)propan-1-ol 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 1-(5-methyloxolan-3-yl)propan-1-ol is sourced from PubChem (CID 115787725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).