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2-methylaniline sulfate hydrate

2-methylaniline sulfate hydrate

Systemtic Name:2-methylaniline sulfate hydrate
Openeye Name:2-methylaniline sulfate hydrate
CAS Name:2-methylaniline sulfate hydrate
IUPAC Name:2-methylaniline sulfate hydrate
Traditional Name:o-toluidine sulfate hydrate
Formula: C7H11NO5S-2
MolecularWeight: 221.23094
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N.O.[O-]S(=O)(=O)[O-]


Isomeric SMILES

CC1=CC=CC=C1N.O.[O-]S(=O)(=O)[O-]


InChI

InChI=1S/C7H9N.H2O4S.H2O/c1-6-4-2-3-5-7(6)8;1-5(2,3)4;/h2-5H,8H2,1H3;(H2,1,2,3,4);1H2/p-2


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