hydron;oxolan-2-ylmethanol

C5H11O2+ — CID 174439667

IUPAChydron;oxolan-2-ylmethanol
SMILESOCC1CCCO1.[H+]
InChIInChI=1S/C5H10O2/c6-4-5-2-1-3-7-5/h5-6H,1-4H2/p+1
InChIKeyBSYVTEYKTMYBMK-UHFFFAOYSA-O
MW103.14 g/mol
LogP0.27
Rot. Bonds1

About hydron;oxolan-2-ylmethanol

hydron;oxolan-2-ylmethanol (PubChem CID 174439667) has the molecular formula C5H11O2+ and a molecular weight of 103.14 g/mol. Its IUPAC name is hydron;oxolan-2-ylmethanol.

Molecular Properties

Compound Namehydron;oxolan-2-ylmethanol
PubChem CID174439667
Molecular FormulaC5H11O2+
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Namehydron;oxolan-2-ylmethanol
SMILESOCC1CCCO1.[H+]
InChIInChI=1S/C5H10O2/c6-4-5-2-1-3-7-5/h5-6H,1-4H2/p+1
InChIKeyBSYVTEYKTMYBMK-UHFFFAOYSA-O
XLogP0.27
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydron;oxolan-2-ylmethanol?
The IUPAC name of hydron;oxolan-2-ylmethanol (CID 174439667) is hydron;oxolan-2-ylmethanol.
What is the SMILES notation for hydron;oxolan-2-ylmethanol?
The canonical SMILES for hydron;oxolan-2-ylmethanol is OCC1CCCO1.[H+].
What is the InChIKey of hydron;oxolan-2-ylmethanol?
The InChIKey is BSYVTEYKTMYBMK-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H10O2/c6-4-5-2-1-3-7-5/h5-6H,1-4H2/p+1.
What are the key properties of hydron;oxolan-2-ylmethanol?
hydron;oxolan-2-ylmethanol has a molecular weight of 103.14 g/mol, XLogP of 0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;oxolan-2-ylmethanol is sourced from PubChem (CID 174439667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).