346403
3-(1H-Tetrazol-5-yl)-9H-thioxanthen-9-one 10,10-dioxide monohydrate
95%
Synonym(s):
Doxantrazole
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About This Item
Empirical Formula (Hill Notation):
C14H8N4O3S · H2O
CAS Number:
Molecular Weight:
330.32
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Recommended Products
assay
95%
mp
255 °C (dec.) (lit.)
SMILES string
[H]O[H].O=C1c2ccccc2S(=O)(=O)c3cc(ccc13)-c4nnn[nH]4
InChI
1S/C14H8N4O3S.H2O/c19-13-9-3-1-2-4-11(9)22(20,21)12-7-8(5-6-10(12)13)14-15-17-18-16-14;/h1-7H,(H,15,16,17,18);1H2
InChI key
YRXFSKFCFQRWHG-UHFFFAOYSA-N
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