N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride

C2F7NO6S3 — CID 142567075

IUPACN,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride
SMILESO=S(=O)(F)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
InChIInChI=1S/C2F7NO6S3/c3-1(4,5)17(11,12)10(19(9,15)16)18(13,14)2(6,7)8
InChIKeyFQUMCUVQIOGWQW-UHFFFAOYSA-N
MW363.21 g/mol
LogP0.20
Rot. Bonds3

About N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride

N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride (PubChem CID 142567075) has the molecular formula C2F7NO6S3 and a molecular weight of 363.21 g/mol. Its IUPAC name is N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride.

Molecular Properties

Compound NameN,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride
PubChem CID142567075
Molecular FormulaC2F7NO6S3
Molecular Weight363.21 g/mol
Exact Mass362.88
IUPAC NameN,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride
SMILESO=S(=O)(F)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
InChIInChI=1S/C2F7NO6S3/c3-1(4,5)17(11,12)10(19(9,15)16)18(13,14)2(6,7)8
InChIKeyFQUMCUVQIOGWQW-UHFFFAOYSA-N
XLogP0.20
TPSA105.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.21
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

lithium N,N-bis(trifluoromethylsulfonyl)sulfamate
CID 153347503
1,1,1-trifluoro-N,N-bis(trimethylstannyl)methanesulfonamide
CID 16693233
2-[difluoro(fluorosulfonyloxy)methyl]-3,3-difluoro-3-fluorosulfonyloxyprop-1-ene
CID 10471472
N,1,1,1-tetrafluoro-N-methylsulfonylmethanesulfonamide
CID 87434293
N-benzyl-N-(trifluoromethylsulfonyl)sulfamoyl fluoride
CID 59403785
N-[2-[2-[bis(trifluoromethylsulfonyl)amino]ethyl-(trifluoromethylsulfonyl)amino]ethyl]-N-[2-[2-[2-[bis(trifluoromethylsulfonyl)amino]ethyl-(trifluoromethylsulfonyl)amino]ethyl-(trifluoromethylsulfonyl)amino]ethyl]-1,1,1-trifluoromethanesulfonamide
CID 102532757
1,1,1-trifluoro-N-nitro-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 165344300
CID 168966122
CID 168966122
1,1,1-trifluoro-N-[2-(hydroxyamino)propan-2-yl]-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 126606287
1,1,1-trifluoro-N-(2-hydroxyethyl)-N-methylmethanesulfonamide
CID 60961276
N-dipropoxysilyl-1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 175909763
1,1,1-trifluoro-N-methyl-N-propa-1,2-dienylmethanesulfonamide
CID 139243670

Frequently Asked Questions

What is the IUPAC name of N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride?
The IUPAC name of N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride (CID 142567075) is N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride.
What is the SMILES notation for N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride?
The canonical SMILES for N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride is O=S(=O)(F)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F.
What is the InChIKey of N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride?
The InChIKey is FQUMCUVQIOGWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2F7NO6S3/c3-1(4,5)17(11,12)10(19(9,15)16)18(13,14)2(6,7)8.
What are the key properties of N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride?
N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride has a molecular weight of 363.21 g/mol, XLogP of 0.20, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(trifluoromethylsulfonyl)sulfamoyl fluoride is sourced from PubChem (CID 142567075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).