N-acetylsulfamoyl chloride

C2H4ClNO3S — CID 21043699

IUPACN-acetylsulfamoyl chloride
SMILESCC(=O)NS(=O)(=O)Cl
InChIInChI=1S/C2H4ClNO3S/c1-2(5)4-8(3,6)7/h1H3,(H,4,5)
InChIKeyRHHZWMIOVCTMJB-UHFFFAOYSA-N
MW157.58 g/mol
LogP-0.39
Rot. Bonds1

About N-acetylsulfamoyl chloride

N-acetylsulfamoyl chloride (PubChem CID 21043699) has the molecular formula C2H4ClNO3S and a molecular weight of 157.58 g/mol. Its IUPAC name is N-acetylsulfamoyl chloride.

Molecular Properties

Compound NameN-acetylsulfamoyl chloride
PubChem CID21043699
Molecular FormulaC2H4ClNO3S
Molecular Weight157.58 g/mol
Exact Mass156.96
IUPAC NameN-acetylsulfamoyl chloride
SMILESCC(=O)NS(=O)(=O)Cl
InChIInChI=1S/C2H4ClNO3S/c1-2(5)4-8(3,6)7/h1H3,(H,4,5)
InChIKeyRHHZWMIOVCTMJB-UHFFFAOYSA-N
XLogP-0.39
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.58
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

chlorosulfonylcarbamothioic S-acid
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N-propan-2-ylsulfonylacetamide
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N-pentanoylsulfamoyl chloride
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N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane
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CID 161312222
CID 161312222
(acetamido-oxo-propan-2-yl-λ6-sulfanylidene)tungsten
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N-[amino(dihydroxy)-λ4-sulfanyl]acetamide;ethane
CID 168951364
silver pentane-2,4-dione
CID 21252539
CID 59966952
CID 59966952
acetamide;methanesulfonyl chloride
CID 158311793
2-(acetylsulfamoyl)-N-(trifluoromethylsulfonyl)acetamide
CID 89050003

Frequently Asked Questions

What is the IUPAC name of N-acetylsulfamoyl chloride?
The IUPAC name of N-acetylsulfamoyl chloride (CID 21043699) is N-acetylsulfamoyl chloride.
What is the SMILES notation for N-acetylsulfamoyl chloride?
The canonical SMILES for N-acetylsulfamoyl chloride is CC(=O)NS(=O)(=O)Cl.
What is the InChIKey of N-acetylsulfamoyl chloride?
The InChIKey is RHHZWMIOVCTMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4ClNO3S/c1-2(5)4-8(3,6)7/h1H3,(H,4,5).
What are the key properties of N-acetylsulfamoyl chloride?
N-acetylsulfamoyl chloride has a molecular weight of 157.58 g/mol, XLogP of -0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetylsulfamoyl chloride is sourced from PubChem (CID 21043699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).