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Silvex diethanolamine salt

HCID 39927
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Basic information

CAS
51170-59-3
Standard SMILES
CC(Oc1cc(Cl)c(Cl)cc1Cl)C(=O)[O-].OCC[NH2+]CCO
InChIKey
LEUXLOMXWDSRIN-UHFFFAOYSA-N
Molecular formula
C13H18Cl3NO5
Average molar mass
374.6 g/mol
Monoisotopic mass
373.025056

Names & identifiers

Preferred name
Silvex diethanolamine salt
IUPAC
bis(2-hydroxyethyl)azanium;2-(2,4,5-trichlorophenoxy)propanoate

Names & synonyms

Silvex diethanolamine salt51170-59-3UNII-X194LQ54MH

Database identifiers

CAS
51170-59-3
PubChem CID
39927

Properties

Computed structural properties

Topological polar surface area
106 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
260

Related reactions

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Compound notes

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