(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol

C11H21FO2 — CID 18684821

IUPAC(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol
SMILESCC1(C)OC(C)(CO)C(C)(F)C1(C)C
InChIInChI=1S/C11H21FO2/c1-8(2)9(3,4)14-10(5,7-13)11(8,6)12/h13H,7H2,1-6H3
InChIKeyVRWAELIXSCJNJR-UHFFFAOYSA-N
MW204.28 g/mol
LogP2.30
Rot. Bonds1

About (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol

(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol (PubChem CID 18684821) has the molecular formula C11H21FO2 and a molecular weight of 204.28 g/mol. Its IUPAC name is (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol.

Molecular Properties

Compound Name(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol
PubChem CID18684821
Molecular FormulaC11H21FO2
Molecular Weight204.28 g/mol
Exact Mass204.15
IUPAC Name(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol
SMILESCC1(C)OC(C)(CO)C(C)(F)C1(C)C
InChIInChI=1S/C11H21FO2/c1-8(2)9(3,4)14-10(5,7-13)11(8,6)12/h13H,7H2,1-6H3
InChIKeyVRWAELIXSCJNJR-UHFFFAOYSA-N
XLogP2.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,5,5-Trimethyloxolan-2-yl)methanol
CID 12634236
Mbedsgglkpenpr-ocaptikfsa-
CID 10702109
2-(2-Tert-butyl-5-methyloxolan-2-yl)propan-2-ol
CID 73001220
[(2S,3R,4R)-4-fluoro-3,4,5-trimethyloxolan-2-yl]methanol
CID 57536206
[(2S,3R,4R,5S)-4-fluoro-3,4,5-trimethyloxolan-2-yl]methanol
CID 68191166
CID 90429294
CID 90429294
[(2S,3S,4R,5S)-3-(fluoromethyl)-4,5-dimethyloxolan-2-yl]methanol
CID 126586760
5-Tert-butyl-4-fluoro-4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]oxolan-3-ol
CID 155619011
[(2S,4S,5S)-2-(fluoromethyl)-4,5-dimethyloxolan-2-yl]methanol
CID 156217346
2-[(2R,5S)-2-tert-butyl-5-methyloxolan-2-yl]propan-2-ol
CID 11542959
2-[(2R,5R)-2-tert-butyl-5-methyloxolan-2-yl]propan-2-ol
CID 11550192
[2,5-Dimethyl-5-(trifluoromethyl)oxolan-2-yl]methanol
CID 130584365

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol?
The IUPAC name of (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol (CID 18684821) is (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol.
What is the SMILES notation for (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol?
The canonical SMILES for (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol is CC1(C)OC(C)(CO)C(C)(F)C1(C)C.
What is the InChIKey of (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol?
The InChIKey is VRWAELIXSCJNJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21FO2/c1-8(2)9(3,4)14-10(5,7-13)11(8,6)12/h13H,7H2,1-6H3.
What are the key properties of (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol?
(3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol has a molecular weight of 204.28 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2,3,4,4,5,5-hexamethyloxolan-2-yl)methanol is sourced from PubChem (CID 18684821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).