Vitas-M small molecule compound

2-amino-5-methyl-4-(propan-2-yl)benzenesulfonate

Catalog ID
STL326525
SMILES CC(c1cc(N)c(cc1C)S(=O)(=O)[O-])C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H14NO3S MW 228.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H15NO3S/c1-6(2)8-5-9(11)10(4-7(8)3)15(12,13)14/h4-6H,11H2,1-3H3,(H,12,13,14)/p-1
InChIKey
LPBOTIYRTGIPKM-UHFFFAOYSA-M
Synonyms

2AMINO5METHYL4(1METHYLETHYL)BENZENESULFONATE
2amino5methyl4(propan2yl)benzenesulfonate
2AMINO5METHYL4PROPAN2YLBENZENESULFONATE
CC(c1cc(N)c(cc1C)S(=O)(=O)(O))C
CC(c1cc(N)c(cc1C)S(=O)(=O)(O))C(K+)
CC1=CC(=C(C=C1C(C)C)N)S(=O)(=O)(O)
InChI=1SC10H15NO3Sc16(2)859(11)10(47(8)3)15(1213)14h46H11H213H3(H121314)p1
MFCD01023976
potassium2amino4isopropyl5methylbenzenesulfonate
ZINC000004688558
ZINC04688558

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.