904816-91-7
TERT-BUTYL 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PIPERAZINE-1-CARBOXYLATE
NameTERT-BUTYL 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PIPERAZINE-1-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PIPERAZINE-1-CARBOXYLATE
【CAS】
【MDL】
MFCD07021288
【English Synonyms】
【Formula】
C12 H21 N5 O2
【MolWeight】
267.331
【Inchi】
InChI=1S/C12H21N5O2/c1-12(2,3)19-11(18)16-6-4-15(5-7-16)10-17-9-13-8-14-17/h8-9H,4-7,10H2,1-3H3
【InChIKey】
InChIKey=RLXVCEBPWOADHO-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCN(CC1)Cn2cncn2
【MOL File】
TERT-BUTYL 4-(1H-1,2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PIPERAZINE-1-CARBOXYLATE.cml