1001067-09-9
2-(TRIMETHYLSILYL)ETHYL 3-NITRO-1H-1,2,4-TRIAZOLE-1-CARBOXYLATE
Name2-(TRIMETHYLSILYL)ETHYL 3-NITRO-1H-1,2,4-TRIAZOLE-1-CARBOXYLATE
1Identification
【Name】
2-(TRIMETHYLSILYL)ETHYL 3-NITRO-1H-1,2,4-TRIAZOLE-1-CARBOXYLATE
【CAS】
【MDL】
MFCD11042686
【English Synonyms】
【Formula】
C8 H14 N4 O4 Si
【MolWeight】
258.309
【Inchi】
InChI=1S/C8H14N4O4Si/c1-17(2,3)5-4-16-8(13)11-6-9-7(10-11)12(14)15/h6H,4-5H2,1-3H3
【InChIKey】
InChIKey=BHTJYIDOVYPNKR-UHFFFAOYSA-N
【SMILES】
C[Si](C)(C)CCOC(=O)n1cnc(n1)[N+](=O)[O-]
【MOL File】
2-(TRIMETHYLSILYL)ET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(TRIMETHYLSILYL)ETHYL 3-NITRO-1H-1,2,4-TRIAZOLE-1-CARBOXYLATE.cml