144035-23-4
5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOLE-3-ETHANAMINE
Name5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOLE-3-ETHANAMINE
1Identification
【Name】
5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOLE-3-ETHANAMINE
【CAS】
【MDL】
MFCD09833115
【English Synonyms】
【Formula】
C13 H15 N5
【MolWeight】
241.296
【Inchi】
InChI=1S/C13H15N5/c14-4-3-11-6-16-13-2-1-10(5-12(11)13)7-18-9-15-8-17-18/h1-2,5-6,8-9,16H,3-4,7,14H2
【InChIKey】
InChIKey=ICKCDMQZVXCGLB-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1Cn3cncn3)c(c[nH]2)CCN
【MOL File】
5-(1H-1,2,4-TRIAZOL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOLE-3-ETHANAMINE.cml