59850-43-0
PHENOL, 4-(1,2-DIHYDROPYRIDO[3,2-E]-1,2,4-TRIAZIN-3-YL)-, HYDROCHLORIDE (1:2)
NamePHENOL, 4-(1,2-DIHYDROPYRIDO[3,2-E]-1,2,4-TRIAZIN-3-YL)-, HYDROCHLORIDE (1:2)
FormulaC12 H10 N4 O . 2 Cl H
1Identification
【Name】
PHENOL, 4-(1,2-DIHYDROPYRIDO[3,2-E]-1,2,4-TRIAZIN-3-YL)-, HYDROCHLORIDE (1:2)
【CAS】
【MDL】
MFCD18827552
【English Synonyms】
【Formula】
C12 H10 N4 O . 2 Cl H
【MolWeight】
299.16
【Inchi】
InChI=1S/C12H10N4O.2ClH/c17-9-5-3-8(4-6-9)11-14-10-2-1-7-13-12(10)16-15-11;;/h1-7,17H,(H,13,16)(H,14,15);2*1H
【InChIKey】
InChIKey=CVZWKHAUDVDZHR-UHFFFAOYSA-N
【SMILES】
c1cc2c(nc1)NNC(=N2)c3ccc(cc3)O.Cl.Cl
【MOL File】
PHENOL, 4-(1,2-DIHYD….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PHENOL, 4-(1,2-DIHYDROPYRIDO[3,2-E]-1,2,4-TRIAZIN-3-YL)-, HYDROCHLORIDE (1:2).cml