864448-35-1
3,7,9-TRIAZABICYCLO[3.3.1]NONANE-3-CARBOXYLIC ACID, 7-METHYL-, 1,1-DIMETHYLETHYL ESTER
Name3,7,9-TRIAZABICYCLO[3.3.1]NONANE-3-CARBOXYLIC ACID, 7-METHYL-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
3,7,9-TRIAZABICYCLO[3.3.1]NONANE-3-CARBOXYLIC ACID, 7-METHYL-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD14635497
【English Synonyms】
【Formula】
C12 H23 N3 O2
【MolWeight】
241.333
【Inchi】
InChI=1S/C12H23N3O2/c1-12(2,3)17-11(16)15-7-9-5-14(4)6-10(8-15)13-9/h9-10,13H,5-8H2,1-4H3/t9-,10+
【InChIKey】
InChIKey=CWJXZSJCSLGNMK-AOOOYVTPSA-N
【SMILES】
CC(C)(C)OC(=O)N1C[C@@H]2CN(C[C@H](C1)N2)C
【MOL File】
3,7,9-TRIAZABICYCLO[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,7,9-TRIAZABICYCLO[3.3.1]NONANE-3-CARBOXYLIC ACID, 7-METHYL-, 1,1-DIMETHYLETHYL ESTER.cml