6-methylheptoxycarbonylmethanethiolate; octyltin
Molecular Formula:
C
38
H
74
O
6
S
3
Sn
InChI:
InChI=1/3C10H20O2S.C8H17.Sn/c3*1-9(2)6-4-3-5-7-12-10(11)8-13;1-3-5-7-8-6-4-2;/h3*9,13H,3-8H2,1-2H3;1,3-8H2,2H3;/q;;;;+3/p-3/f3C10H19O2S.C8H17.Sn/h3*13h;;/q3*-1;;m/r3C10H20O2S.C8H17Sn/c3*1-9(2)6-4-3-5-7-12-10(11)8-13;1-2-3-4-5-6-7-8-9/h3*9,13H,3-8H2,1-2H3;2-8H2,1H3/q;;;+3/p-3/f3C10H19O2S.C8H17Sn/h3*13h;/q3*-1;m
InChIKey:
InChIKey=GNJDFZSTSXEBCH-JEGPSMQSCM
SMILES:
CCCCCCCC[Sn+3].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-]
Names:
6-methylheptoxycarbonylmethanethiolate; octyltin
Registries:
PubChem CID 6101648
PubChem ID 10226481
