954110-17-9
TERT-BUTYL 3-FORMYL-6,7-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-4(5H)-CARBOXYLATE
NameTERT-BUTYL 3-FORMYL-6,7-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-4(5H)-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 3-FORMYL-6,7-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-4(5H)-CARBOXYLATE
【CAS】
【MDL】
MFCD13195412
【English Synonyms】
【Formula】
C12 H17 N3 O3
【MolWeight】
251.284
【Inchi】
InChI=1S/C12H17N3O3/c1-12(2,3)18-11(17)14-5-4-6-15-10(14)9(8-16)7-13-15/h7-8H,4-6H2,1-3H3
【InChIKey】
InChIKey=JVFUDRVWTGXPDQ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCCn2c1c(cn2)C=O
【MOL File】
TERT-BUTYL 3-FORMYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 3-FORMYL-6,7-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-4(5H)-CARBOXYLATE.cml