591221-28-2
2,2-DIMETHYL-6-NITRO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE
Name2,2-DIMETHYL-6-NITRO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE
1Identification
【Name】
2,2-DIMETHYL-6-NITRO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE
【CAS】
【MDL】
MFCD06496126
【English Synonyms】
【Formula】
C10 H12 N2 O2 S
【MolWeight】
224.283
【Inchi】
InChI=1S/C10H12N2O2S/c1-10(2)6-11-8-5-7(12(13)14)3-4-9(8)15-10/h3-5,11H,6H2,1-2H3
【InChIKey】
InChIKey=NOEANMCVKSTVRY-UHFFFAOYSA-N
【SMILES】
CC1(CNc2cc(ccc2S1)[N+](=O)[O-])C
【MOL File】
2,2-DIMETHYL-6-NITRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,2-DIMETHYL-6-NITRO-3,4-DIHYDRO-2H-1,4-BENZOTHIAZINE.cml