[(3R)-3-methyloxolan-3-yl]methanol

C6H12O2 — CID 53302254

IUPAC[(3R)-3-methyloxolan-3-yl]methanol
SMILESC[C@]1(CO)CCOC1
InChIInChI=1S/C6H12O2/c1-6(4-7)2-3-8-5-6/h7H,2-5H2,1H3/t6-/m1/s1
InChIKeyPEUKZUNHDBBJQH-ZCFIWIBFSA-N
MW116.16 g/mol
LogP0.41
Rot. Bonds1

About [(3R)-3-methyloxolan-3-yl]methanol

[(3R)-3-methyloxolan-3-yl]methanol (PubChem CID 53302254) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is [(3R)-3-methyloxolan-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-3-methyloxolan-3-yl]methanol
PubChem CID53302254
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Name[(3R)-3-methyloxolan-3-yl]methanol
SMILESC[C@]1(CO)CCOC1
InChIInChI=1S/C6H12O2/c1-6(4-7)2-3-8-5-6/h7H,2-5H2,1H3/t6-/m1/s1
InChIKeyPEUKZUNHDBBJQH-ZCFIWIBFSA-N
XLogP0.41
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(3R)-3-methyloxolan-3-yl]methanol?
The IUPAC name of [(3R)-3-methyloxolan-3-yl]methanol (CID 53302254) is [(3R)-3-methyloxolan-3-yl]methanol.
What is the SMILES notation for [(3R)-3-methyloxolan-3-yl]methanol?
The canonical SMILES for [(3R)-3-methyloxolan-3-yl]methanol is C[C@]1(CO)CCOC1.
What is the InChIKey of [(3R)-3-methyloxolan-3-yl]methanol?
The InChIKey is PEUKZUNHDBBJQH-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H12O2/c1-6(4-7)2-3-8-5-6/h7H,2-5H2,1H3/t6-/m1/s1.
What are the key properties of [(3R)-3-methyloxolan-3-yl]methanol?
[(3R)-3-methyloxolan-3-yl]methanol has a molecular weight of 116.16 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-methyloxolan-3-yl]methanol is sourced from PubChem (CID 53302254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).