740873-01-2
tert-butyl (4-(4-(3-nitrophenyl)piperazin-1-yl)butyl)carbamate
Nametert-butyl (4-(4-(3-nitrophenyl)piperazin-1-yl)butyl)carbamate
1Identification
【Name】
tert-butyl (4-(4-(3-nitrophenyl)piperazin-1-yl)butyl)carbamate
【CAS】
【MDL】
【English Synonyms】
【Formula】
C19H30N4O4
【MolWeight】
378.4659
【Inchi】
InChI=1S/C19H30N4O4/c1-19(2,3)27-18(24)20-9-4-5-10-21-11-13-22(14-12-21)16-7-6-8-17(15-16)23(25)26/h6-8,15H,4-5,9-14H2,1-3H3,(H,20,24)
【InChIKey】
InChIKey=NFGFTYLKLHKHDH-UHFFFAOYSA-N
【SMILES】
[N+](=O)([O-])C=1C=C(C=CC1)N1CCN(CC1)CCCCNC(OC(C)(C)C)=O
【MOL File】
tert-butyl (4-(4-(3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
tert-butyl (4-(4-(3-nitrophenyl)piperazin-1-yl)butyl)carbamate.cml