4576-90-3
3-ISOTHIAZOLECARBOXYLIC ACID
Name
3-ISOTHIAZOLECARBOXYLIC ACID
Formula
C4 H3 N O2 S
MolWeight
129.139
1Identification
【Name】
3-ISOTHIAZOLECARBOXYLIC ACID
【CAS】
【MDL】
MFCD09834765
【English Synonyms】
【Formula】
C4 H3 N O2 S
【MolWeight】
129.139
【Inchi】
InChI=1S/C4H3NO2S/c6-4(7)3-1-2-8-5-3/h1-2H,(H,6,7)
【InChIKey】
InChIKey=BMPVWNJQCJQBFW-UHFFFAOYSA-N
【SMILES】
c1csnc1C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3-ISOTHIAZOLECARBOXYLIC ACID.cml
Quick Release
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