2-butan-2-yloxypropan-1-ol;fluoromethane

C8H19FO2 — CID 145107348

IUPAC2-butan-2-yloxypropan-1-ol;fluoromethane
SMILESCCC(C)OC(C)CO.CF
InChIInChI=1S/C7H16O2.CH3F/c1-4-6(2)9-7(3)5-8;1-2/h6-8H,4-5H2,1-3H3;1H3
InChIKeyLQOXQGLPOJGFHX-UHFFFAOYSA-N
MW166.24 g/mol
LogP1.77
Rot. Bonds4

About 2-butan-2-yloxypropan-1-ol;fluoromethane

2-butan-2-yloxypropan-1-ol;fluoromethane (PubChem CID 145107348) has the molecular formula C8H19FO2 and a molecular weight of 166.24 g/mol. Its IUPAC name is 2-butan-2-yloxypropan-1-ol;fluoromethane.

Molecular Properties

Compound Name2-butan-2-yloxypropan-1-ol;fluoromethane
PubChem CID145107348
Molecular FormulaC8H19FO2
Molecular Weight166.24 g/mol
Exact Mass166.14
IUPAC Name2-butan-2-yloxypropan-1-ol;fluoromethane
SMILESCCC(C)OC(C)CO.CF
InChIInChI=1S/C7H16O2.CH3F/c1-4-6(2)9-7(3)5-8;1-2/h6-8H,4-5H2,1-3H3;1H3
InChIKeyLQOXQGLPOJGFHX-UHFFFAOYSA-N
XLogP1.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.24
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yloxybutane;ethanol
CID 88614162
azane;2-butan-2-yloxybutane
CID 87187028
2-butan-2-yloxybutane;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 87745303
2-butan-2-yloxybutane;3-methylbutan-1-ol
CID 175296093
2-(1-hydroxypropan-2-yloxy)propane-1,3-diol
CID 54551679
(2S)-2-(1-aminoethoxy)propan-1-ol
CID 142604157
(1R)-1-[(2R)-butan-2-yl]oxypropan-1-ol
CID 88904720
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)propan-1-ol
CID 175979976
(2S)-2-[(1R)-1-ethoxyethoxy]propan-1-ol
CID 101001545
2-butan-2-yloxybutane;ethane-1,2-diol;bis(2-sulfanylacetic acid)
CID 174496086
2-[1-(2-propoxypropoxy)propan-2-yloxy]propan-1-ol
CID 57495087
2,3-di(butan-2-yloxy)butanedioic acid
CID 87883512

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yloxypropan-1-ol;fluoromethane?
The IUPAC name of 2-butan-2-yloxypropan-1-ol;fluoromethane (CID 145107348) is 2-butan-2-yloxypropan-1-ol;fluoromethane.
What is the SMILES notation for 2-butan-2-yloxypropan-1-ol;fluoromethane?
The canonical SMILES for 2-butan-2-yloxypropan-1-ol;fluoromethane is CCC(C)OC(C)CO.CF.
What is the InChIKey of 2-butan-2-yloxypropan-1-ol;fluoromethane?
The InChIKey is LQOXQGLPOJGFHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2.CH3F/c1-4-6(2)9-7(3)5-8;1-2/h6-8H,4-5H2,1-3H3;1H3.
What are the key properties of 2-butan-2-yloxypropan-1-ol;fluoromethane?
2-butan-2-yloxypropan-1-ol;fluoromethane has a molecular weight of 166.24 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yloxypropan-1-ol;fluoromethane is sourced from PubChem (CID 145107348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).