tert-butyl-fluoro-imino-oxo-λ6-sulfane

C4H10FNOS — CID 169174365

IUPACtert-butyl-fluoro-imino-oxo-λ6-sulfane
SMILES[H]N=S(=O)(F)C(C)(C)C
InChIInChI=1S/C4H10FNOS/c1-4(2,3)8(5,6)7/h6H,1-3H3
InChIKeyONRNVWKAFPQARZ-UHFFFAOYSA-N
MW139.19 g/mol
LogP1.72
Rot. Bonds

About tert-butyl-fluoro-imino-oxo-λ6-sulfane

tert-butyl-fluoro-imino-oxo-λ6-sulfane (PubChem CID 169174365) has the molecular formula C4H10FNOS and a molecular weight of 139.19 g/mol. Its IUPAC name is tert-butyl-fluoro-imino-oxo-λ6-sulfane.

Molecular Properties

Compound Nametert-butyl-fluoro-imino-oxo-λ6-sulfane
PubChem CID169174365
Molecular FormulaC4H10FNOS
Molecular Weight139.19 g/mol
Exact Mass139.05
IUPAC Nametert-butyl-fluoro-imino-oxo-λ6-sulfane
SMILES[H]N=S(=O)(F)C(C)(C)C
InChIInChI=1S/C4H10FNOS/c1-4(2,3)8(5,6)7/h6H,1-3H3
InChIKeyONRNVWKAFPQARZ-UHFFFAOYSA-N
XLogP1.72
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.19
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Tert-Butanesulfinamide
CID 3382465
tert-Butylsulfinamide, (R)-(+)-
CID 10964479
tert-Butylsulfinamide, (S)-(-)-
CID 11355477
(R)-2-Methylbutane-2-sulfinamide
CID 53487354
2-Methylbutane-2-sulfinamide
CID 76045584
t-Butylsulfinylimine
CID 123757712
(R)-N-fluoro-2-methylpropane-2-sulfinamide
CID 172690083
Amino-(1-fluoro-2-methylpropan-2-yl)-oxidosulfanium
CID 176207954
[(R)-tert-butylsulfinyl]azanium
CID 134864963
(S)-2-Methylbutane-2-sulfinamide
CID 12178464
CID 57658914
CID 57658914
Tert-butylsulfinylazanium
CID 58516118

Frequently Asked Questions

What is the IUPAC name of tert-butyl-fluoro-imino-oxo-λ6-sulfane?
The IUPAC name of tert-butyl-fluoro-imino-oxo-λ6-sulfane (CID 169174365) is tert-butyl-fluoro-imino-oxo-λ6-sulfane.
What is the SMILES notation for tert-butyl-fluoro-imino-oxo-λ6-sulfane?
The canonical SMILES for tert-butyl-fluoro-imino-oxo-λ6-sulfane is [H]N=S(=O)(F)C(C)(C)C.
What is the InChIKey of tert-butyl-fluoro-imino-oxo-λ6-sulfane?
The InChIKey is ONRNVWKAFPQARZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNOS/c1-4(2,3)8(5,6)7/h6H,1-3H3.
What are the key properties of tert-butyl-fluoro-imino-oxo-λ6-sulfane?
tert-butyl-fluoro-imino-oxo-λ6-sulfane has a molecular weight of 139.19 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-fluoro-imino-oxo-λ6-sulfane is sourced from PubChem (CID 169174365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).