[3-(difluoromethyl)oxolan-3-yl]methanol

C6H10F2O2 — CID 163297243

IUPAC[3-(difluoromethyl)oxolan-3-yl]methanol
SMILESOCC1(C(F)F)CCOC1
InChIInChI=1S/C6H10F2O2/c7-5(8)6(3-9)1-2-10-4-6/h5,9H,1-4H2
InChIKeyUWQGGTPBWJXBOH-UHFFFAOYSA-N
MW152.14 g/mol
LogP0.65
Rot. Bonds2

About [3-(difluoromethyl)oxolan-3-yl]methanol

[3-(difluoromethyl)oxolan-3-yl]methanol (PubChem CID 163297243) has the molecular formula C6H10F2O2 and a molecular weight of 152.14 g/mol. Its IUPAC name is [3-(difluoromethyl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[3-(difluoromethyl)oxolan-3-yl]methanol
PubChem CID163297243
Molecular FormulaC6H10F2O2
Molecular Weight152.14 g/mol
Exact Mass152.06
IUPAC Name[3-(difluoromethyl)oxolan-3-yl]methanol
SMILESOCC1(C(F)F)CCOC1
InChIInChI=1S/C6H10F2O2/c7-5(8)6(3-9)1-2-10-4-6/h5,9H,1-4H2
InChIKeyUWQGGTPBWJXBOH-UHFFFAOYSA-N
XLogP0.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.14
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(3S)-3-methyloxolan-3-yl]methanol
CID 55297872
Tetrahydro-3-methyl-3-furanmethanol
CID 13306877
[(3R)-3-methyloxolan-3-yl]methanol
CID 53302254
(3-Fluorooxolan-3-yl)methanol
CID 76003333
(4,4-Difluorooxolan-3-yl)methanol
CID 105427956
[3-(Methoxymethyl)oxolan-3-yl]methanol
CID 121599156
[(3R)-3-fluorooxolan-3-yl]methanol
CID 56973678
2-(Hydroxymethyl)-2-(trifluoromethyl)butane-1,4-diol
CID 21297508
[2,2,3,4,5,5-Hexafluoro-4-(hydroxymethyl)oxolan-3-yl]methanol
CID 58017934
2-Ethyl-2-(2,2,2-trifluoroethoxymethyl)propane-1,3-diol
CID 106706615
2-(2-Methoxyethyl)-2-(trifluoromethyl)propane-1,3-diol
CID 134526982
(5-Fluorooxolan-3-yl)methanol
CID 140989211

Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethyl)oxolan-3-yl]methanol?
The IUPAC name of [3-(difluoromethyl)oxolan-3-yl]methanol (CID 163297243) is [3-(difluoromethyl)oxolan-3-yl]methanol.
What is the SMILES notation for [3-(difluoromethyl)oxolan-3-yl]methanol?
The canonical SMILES for [3-(difluoromethyl)oxolan-3-yl]methanol is OCC1(C(F)F)CCOC1.
What is the InChIKey of [3-(difluoromethyl)oxolan-3-yl]methanol?
The InChIKey is UWQGGTPBWJXBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O2/c7-5(8)6(3-9)1-2-10-4-6/h5,9H,1-4H2.
What are the key properties of [3-(difluoromethyl)oxolan-3-yl]methanol?
[3-(difluoromethyl)oxolan-3-yl]methanol has a molecular weight of 152.14 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethyl)oxolan-3-yl]methanol is sourced from PubChem (CID 163297243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).