128293-63-0
ETHYL 4-(TERT-BUTOXYCARBONYLAMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBOXYLATE
NameETHYL 4-(TERT-BUTOXYCARBONYLAMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBOXYLATE
1Identification
【Name】
ETHYL 4-(TERT-BUTOXYCARBONYLAMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD16876078
【English Synonyms】
【Formula】
C12 H19 N3 O4
【MolWeight】
269.299
【Inchi】
InChI=1S/C12H19N3O4/c1-6-18-10(16)9-13-8(7-15(9)5)14-11(17)19-12(2,3)4/h7H,6H2,1-5H3,(H,14,17)
【InChIKey】
InChIKey=VKDFVUFMCCONBE-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1nc(cn1C)NC(=O)OC(C)(C)C
【MOL File】
ETHYL 4-(TERT-BUTOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(TERT-BUTOXYCARBONYLAMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBOXYLATE.cml