91260-72-9
5,6-DIAMINO-1-BUTYL-3-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE
Name5,6-DIAMINO-1-BUTYL-3-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE
1Identification
【Name】
5,6-DIAMINO-1-BUTYL-3-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE
【CAS】
【MDL】
MFCD06335080
【English Synonyms】
【Formula】
C9 H16 N4 O2
【MolWeight】
212.251
【Inchi】
InChI=1S/C9H16N4O2/c1-3-4-5-13-7(11)6(10)8(14)12(2)9(13)15/h3-5,10-11H2,1-2H3
【InChIKey】
InChIKey=OWZSVHVLJNZPOK-UHFFFAOYSA-N
【SMILES】
CCCCn1c(c(c(=O)n(c1=O)C)N)N
【MOL File】
5,6-DIAMINO-1-BUTYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5,6-DIAMINO-1-BUTYL-3-METHYLPYRIMIDINE-2,4(1H,3H)-DIONE.cml