(2-(1-Methyl-2-phenylethyl)hydrazine-1,1-diyl)dimethanesulfonic acid

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Basic information

CAS: 3583-82-2
Standard SMILES: CC(Cc1ccccc1)NN(CS(=O)(=O)O)CS(=O)(=O)O
InChIKey: MYWFEIUSQKFJPJ-UHFFFAOYSA-N
Molecular formula: C11H18N2O6S2
Average molar mass: 338.4 g/mol
Monoisotopic mass: 338.06062865

Names & identifiers

Preferred name: (2-(1-Methyl-2-phenylethyl)hydrazine-1,1-diyl)dimethanesulfonic acid
IUPAC: [(1-phenylpropan-2-ylamino)-(sulfomethyl)amino]methanesulfonic acid

Names & synonyms

NSC 220353583-82-2(2-(1-methyl-2-phenylethyl)hydrazine-1,1-diyl)dimethanesulfonic acidNSC22035[2-(1-methyl-2-phenylethyl)hydrazine-1,1-diyl]dimethanesulfonic acid[[(1-methyl-2-phenyl-ethyl)amino]-(sulfomethyl)amino]methanesulfonic acid

Database identifiers

CAS: 3583-82-2
PubChem CID: 409528

Properties

Computed structural properties

XLogP: -4.2
Topological polar surface area: 141 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 8
Rotatable bonds: 8
Heavy atoms: 21
Formal charge: 0
Complexity: 468

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Compound notes

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