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3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
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3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
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CAS No:
381165-97-5
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Formula:
C10H16N2O3S2
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Chemical Name:
3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
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Synonyms:
MLS001002008;CHEMBL1343863;HMS2600B21;AKOS034457994;MCULE-2452083961;SMR000353365;Z56821863;2-amino-3-(3-sulfopropyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium;381165-97-5
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CAS No:
3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate Basic Attributes
276.4 g/mol
276.06023472 g/mol
Computed Properties
Molecular Weight:276.4
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:276.06023472
Monoisotopic Mass:276.06023472
Topological Polar Surface Area:124
Heavy Atom Count:17
Complexity:342
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
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