2-fluoro-3-methoxy-2-methylbutane

C6H13FO — CID 12700782

IUPAC2-fluoro-3-methoxy-2-methylbutane
SMILESCOC(C)C(C)(C)F
InChIInChI=1S/C6H13FO/c1-5(8-4)6(2,3)7/h5H,1-4H3
InChIKeyLKVKVELPTOWVMT-UHFFFAOYSA-N
MW120.17 g/mol
LogP1.77
Rot. Bonds2

About 2-fluoro-3-methoxy-2-methylbutane

2-fluoro-3-methoxy-2-methylbutane (PubChem CID 12700782) has the molecular formula C6H13FO and a molecular weight of 120.17 g/mol. Its IUPAC name is 2-fluoro-3-methoxy-2-methylbutane.

Molecular Properties

Compound Name2-fluoro-3-methoxy-2-methylbutane
PubChem CID12700782
Molecular FormulaC6H13FO
Molecular Weight120.17 g/mol
Exact Mass120.10
IUPAC Name2-fluoro-3-methoxy-2-methylbutane
SMILESCOC(C)C(C)(C)F
InChIInChI=1S/C6H13FO/c1-5(8-4)6(2,3)7/h5H,1-4H3
InChIKeyLKVKVELPTOWVMT-UHFFFAOYSA-N
XLogP1.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.17
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Butane, 2-methoxy-3-methyl-
CID 547676
Isopropyl fluoromethyl ether
CID 21954138
1,2-Dimethylpropyl methyl ether
CID 59039402
3-Fluoro-2-methoxy-2-methylbutane
CID 12700783
2-(2-Fluoropropan-2-yl)oxirane
CID 14364415
2-Fluoro-2-methyl-1-propan-2-yloxypropane
CID 20782655
1-Fluoro-2-methoxybutane
CID 20783144
2-Fluoro-3-(fluoromethoxy)butane
CID 20793145
1,3-Difluoro-2-methoxypropane
CID 20798611
(4-Fluoro-3-methylbutan-2-yl) hypofluorite
CID 20802300
1-Fluoro-2-(fluoromethoxy)butane
CID 21137997
2-Fluoro-3-methoxybutane
CID 21749122

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methoxy-2-methylbutane?
The IUPAC name of 2-fluoro-3-methoxy-2-methylbutane (CID 12700782) is 2-fluoro-3-methoxy-2-methylbutane.
What is the SMILES notation for 2-fluoro-3-methoxy-2-methylbutane?
The canonical SMILES for 2-fluoro-3-methoxy-2-methylbutane is COC(C)C(C)(C)F.
What is the InChIKey of 2-fluoro-3-methoxy-2-methylbutane?
The InChIKey is LKVKVELPTOWVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FO/c1-5(8-4)6(2,3)7/h5H,1-4H3.
What are the key properties of 2-fluoro-3-methoxy-2-methylbutane?
2-fluoro-3-methoxy-2-methylbutane has a molecular weight of 120.17 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methoxy-2-methylbutane is sourced from PubChem (CID 12700782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).