686321-80-2
N-(2-(9H-PURIN-6-YL)ETHYL)BUTAN-1-AMINE
NameN-(2-(9H-PURIN-6-YL)ETHYL)BUTAN-1-AMINE
1Identification
【Name】
N-(2-(9H-PURIN-6-YL)ETHYL)BUTAN-1-AMINE
【CAS】
【MDL】
MFCD11505840
【English Synonyms】
【Formula】
C11 H17 N5
【MolWeight】
219.29
【Inchi】
InChI=1S/C11H17N5/c1-2-3-5-12-6-4-9-10-11(15-7-13-9)16-8-14-10/h7-8,12H,2-6H2,1H3,(H,13,14,15,16)
【InChIKey】
InChIKey=SFIHNICGVHIFLK-UHFFFAOYSA-N
【SMILES】
CCCCNCCc1c2c([nH]cn2)ncn1
【MOL File】
N-(2-(9H-PURIN-6-YL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-(9H-PURIN-6-YL)ETHYL)BUTAN-1-AMINE.cml