English name: Ganciclovir
CAS number: 82410-32-0
Molecular formula: C9H13N5O4
Molecular weight: 255.23
EINECS number: 627-054-3
MDL No. : MFCD00870588
Stats
Melting point 250°C
Boiling point 398.46°C (rough estimate)
Density 1.3559 (rough estimate)
Refractive index 1.7610 (estimate)
Flash point 9℃
Storage conditions 2-8°C
Solubility 0.1M HCl: 10 mg/mL
Acidity coefficient (pKa)9.33±0.20(Predicted)
Morphology powder
Color white
Water solubility 3.6g/L(25 ºC)
Merck14, 4363
InChIInChI = 1 s/C9H13N5O4 / c10 - the 9-12-7-6-8 (17) 13-9), 11-3-14 (7), 11-3-14 (1-15) 2-16 / h3, 5, 15, 16 h, 1 to 2, 4 H2, (h3, 10,12,13,17)
InChIKeyIRSCQMHQWWYFCW-UHFFFAOYSA-N
SMILESN1C2=C(N=C(N)NC2=O)N(COC(CO)CO)C=1
Safety information
GHS hazard pictograms GHS Hazard pictograms
GHS08
Danger
Hazard Description H340-H361fd
Precautions P201-P308+P313
Dangerous goods mark T
Hazard category code 46-60-61
Safety information 53-36/37/39-45
Dangerous goods transport number UN1230-class 3-PG 2-Methanol, solution
WGK Germany3
RTECS number MF8407000
Customs Code: 29335990
Toxicity LD50 i.p. in mice: 1-2 g/kg (Martin)


