19800-79-4
7-ALLYL-8-(1-(2-HYDROXYETHYL)HYDRAZINO)THEOPHYLLINE
Name7-ALLYL-8-(1-(2-HYDROXYETHYL)HYDRAZINO)THEOPHYLLINE
1Identification
【Name】
7-ALLYL-8-(1-(2-HYDROXYETHYL)HYDRAZINO)THEOPHYLLINE
【CAS】
【MDL】
MFCD01682371
【English Synonyms】
【Formula】
C12 H18 N6 O3
【MolWeight】
294.313
【Inchi】
InChI=1S/C12H18N6O3/c1-4-5-17-8-9(14-11(17)18(13)6-7-19)15(2)12(21)16(3)10(8)20/h4,19H,1,5-7,13H2,2-3H3
【InChIKey】
InChIKey=LVZHNCNPYSPMAV-UHFFFAOYSA-N
【SMILES】
Cn1c2c(c(=O)n(c1=O)C)n(c(n2)N(CCO)N)CC=C
【MOL File】
7-ALLYL-8-(1-(2-HYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7-ALLYL-8-(1-(2-HYDROXYETHYL)HYDRAZINO)THEOPHYLLINE.cml