623565-07-1
6,7-DIHYDRO-4H-PYRAZOLO[5,1-C][1,4]THIAZINE-2-CARBALDEHYDE DIOXIDE
Name6,7-DIHYDRO-4H-PYRAZOLO[5,1-C][1,4]THIAZINE-2-CARBALDEHYDE DIOXIDE
1Identification
【Name】
6,7-DIHYDRO-4H-PYRAZOLO[5,1-C][1,4]THIAZINE-2-CARBALDEHYDE DIOXIDE
【CAS】
【MDL】
MFCD17011860
【English Synonyms】
【Formula】
C7 H8 N2 O3 S
【MolWeight】
200.217
【Inchi】
InChI=1S/C7H8N2O3S/c10-4-6-3-7-5-13(11,12)2-1-9(7)8-6/h3-4H,1-2,5H2
【InChIKey】
InChIKey=XHIIEHUJWFAWJV-UHFFFAOYSA-N
【SMILES】
c1c2n(nc1C=O)CCS(=O)(=O)C2
【MOL File】
6,7-DIHYDRO-4H-PYRAZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
6,7-DIHYDRO-4H-PYRAZOLO[5,1-C][1,4]THIAZINE-2-CARBALDEHYDE DIOXIDE.cml