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4-[(1e)-3,3-Bis(2-hydroxyethyl)triaz-1-en-1-yl]benzenesulfonamide

HCID 220686
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Basic information

CAS
5347-11-5
Standard SMILES
NS(=O)(=O)c1ccc(N=NN(CCO)CCO)cc1
InChIKey
YLEMUKSMJIGGAK-UHFFFAOYSA-N
Molecular formula
C10H16N4O4S
Average molar mass
288.33 g/mol
Monoisotopic mass
288.08922618

Names & identifiers

Preferred name
4-[(1e)-3,3-Bis(2-hydroxyethyl)triaz-1-en-1-yl]benzenesulfonamide
IUPAC
4-[[bis(2-hydroxyethyl)amino]diazenyl]benzenesulfonamide

Names & synonyms

5347-11-54-[(1e)-3,3-bis(2-hydroxyethyl)triaz-1-en-1-yl]benzenesulfonamideNSC3744DTXSID20277732NSC-37444-[(1E)-3,3-Bis(2-hydroxyethyl)triaz-1-en-1-yl]benzene-1-sulfonamide

Database identifiers

CAS
5347-11-5
PubChem CID
220686
DTXSID
DTXSID20277732

Properties

Computed structural properties

XLogP
-0.3
Topological polar surface area
137 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
19
Formal charge
0
Complexity
367

Related reactions

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Compound notes

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