130593-24-7
2-BENZOTHIAZOLECARBONITRILE, 6-METHOXY-4-METHYL-
Name2-BENZOTHIAZOLECARBONITRILE, 6-METHOXY-4-METHYL-
1Identification
【Name】
2-BENZOTHIAZOLECARBONITRILE, 6-METHOXY-4-METHYL-
【CAS】
【MDL】
MFCD12964180
【English Synonyms】
【Formula】
C10 H8 N2 O S
【MolWeight】
204.252
【Inchi】
InChI=1S/C10H8N2OS/c1-6-3-7(13-2)4-8-10(6)12-9(5-11)14-8/h3-4H,1-2H3
【InChIKey】
InChIKey=FYTQITYKFFXNCC-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc2c1nc(s2)C#N)OC
【MOL File】
2-BENZOTHIAZOLECARBO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-BENZOTHIAZOLECARBONITRILE, 6-METHOXY-4-METHYL-.cml