Cas no 88110-89-8 (Ganciclovir Mono-O-acetate)

Ganciclovir Mono-O-acetate structure
Ganciclovir Mono-O-acetate structure
Product Name:Ganciclovir Mono-O-acetate
CAS No:88110-89-8
MF:C11H15N5O5
MW:297.267301797867
MDL:MFCD09840659
CID:709205
PubChem ID:135459820
Update Time:2024-10-26

Ganciclovir Mono-O-acetate Chemical and Physical Properties

Names and Identifiers

    • 6H-Purin-6-one,9-[[2-(acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-
    • Ganciclovir Mono-O-acetate
    • [2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-3-hydroxypropyl] acetate
    • 2-[(2-Amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-3-acetoxy-1-propanol
    • Valganciclovir
    • 6H-Purin-6-one
    • 2-(2-amino-1,6 dihydro-6-oxo-purine-9-yl)-methoxy-3 acetoxy-1-propanol
    • 9-<(1-acetoxy-2-hydroxymethyl)ethoxymethyl>guanine
    • CS-0950
    • ganciclovir monoacetate
    • HY-A0032
    • O-acetoxy ganciclovir
    • 9-[[2-(Acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-6H-purin-6-one
    • Mono-O-AcetylGanciclovir
    • 2-[(2-Amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl acetate
    • 2-((2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy)-3-hydroxypropyl acetate
    • monoacetyl ganciclovir
    • ganciclovir monoacetate;
    • BCP09940
    • 9-[[2-(Acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-6H-purin-6-one (ACI)
    • 3-Hydroxy-2-((2-imino-6-oxo-2,3-dihydro-1H-purin-9(6H)-yl)methoxy)propyl acetate
    • AC-23921
    • 6H-Purin-6-one, 9-[[2-(acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-; 2-[(2-Amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-3-acetoxy-1-propanol; 2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl acetate; Ganciclovir Mono-O-acetate; Monoacetoxyganciclovir; O-Acetoxyganciclovir
    • 2-[(2-AMINO-6-OXO-1H-PURIN-9-YL)METHOXY]-3-HYDROXYPROPYL ACETATE
    • SCHEMBL5555694
    • 9-((2-(ACETYLOXY)-1-(HYDROXYMETHYL)ETHOXY)METHYL)-2-AMINO-1,9-DIHYDRO-6H-PURIN-6-ONE
    • 9-[[2-(Acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro- 6H-Purin-6-one
    • MONOACETOXYGANCICLOVIR [USP IMPURITY]
    • SCHEMBL12660403
    • EC 680-297-7
    • HY-41344
    • [2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]-3-hydroxypropyl] acetate
    • 2-((2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy)-3-hydroxypropyl acetate
    • 6H-Purin-6-one, 9-[[2-(acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-
    • 6H-PURIN-6-ONE, 9-((2-(ACETYLOXY)-1-(HYDROXYMETHYL)ETHOXY)METHYL)-2-AMINO-1,9-DIHYDRO-
    • DS-19642
    • 9-[[2-(Acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro- 6H-Purin-6-on
    • AKOS025401637
    • MONOACETOXYGANCICLOVIR
    • [2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]-3-hydroxy-propyl] acetate
    • AKOS040758429
    • NS00006101
    • 88110-89-8
    • VOP6XHY7OL
    • 2-((2-Amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy)-3-acetoxy-1-propanol
    • UNII-VOP6XHY7OL
    • MONOACETOXY GANCICLOVIR
    • DTXSID60333225
    • CS-M3368
    • Mono-O-Acetyl Ganciclovir
    • MDL： MFCD09840659
    • Inchi： 1S/C11H15N5O5/c1-6(18)20-3-7(2-17)21-5-16-4-13-8-9(16)14-11(12)15-10(8)19/h4,7,17H,2-3,5H2,1H3,(H3,12,14,15,19)
    • InChI Key： YKLKCCHLLFMWQE-UHFFFAOYSA-N
    • SMILES： O=C1C2N=CN(C=2NC(N)=N1)COC(COC(C)=O)CO

Computed Properties

  • Exact Mass: 297.10700
  • Monoisotopic Mass: 297.10731860g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 7
  • Complexity: 443
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 141
  • XLogP3: -2

Experimental Properties

  • Density: 1.66
  • Melting Point: 194-197°C
  • Boiling Point: 607.8°C at 760 mmHg
  • Flash Point: 321.4°C
  • Refractive Index: 1.691
  • PSA: 145.35000
  • LogP: -0.81890

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Ganciclovir Mono-O-acetate Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrogen ,  Hydrochloric acid Catalysts: Palladium dihydroxide Solvents: Methanol ,  Water ;  3 h, rt
Reference
Novel synthesis of process related impurities of valganciclovir hydrochloride
Napoleon, Ayyakannu Arumugam; Angajala, Gangadhara; Kumar, Rakesh, International Journal of Pharmacy and Pharmaceutical Sciences, 2016, 8(4), 29-31

Production Method 2

Reaction Conditions
1.1 Reagents: Trifluoroacetic acid Solvents: Dimethylformamide ;  4 d, rt
1.2 Reagents: Water ;  overnight, rt
Reference
Prodrug Approach for Posterior Eye Drug Delivery: Synthesis of Novel Ganciclovir Prodrugs and in Vitro Screening with Cassette Dosing
Heikkinen, Emma M. ; Ruponen, Marika; Jasper, Lisa-Marie; Leppanen, Jukka; Hellinen, Laura ; et al, Molecular Pharmaceutics, 2020, 17(6), 1945-1953

Production Method 3

Reaction Conditions
1.1 Reagents: Methylamine Solvents: Reline ;  30 h, 15 - 20 °C
Reference
Choline chloride-urea: an efficient, green media for partial hydrolysis of di- and tri-protected ganciclovir and selective o-acylation in the synthesis of antiviral drug valganciclovir
Goswami-Giri, Anita; Dhawle, Pranaya P., World Journal of Pharmaceutical Research, 2018, 7(7), 1-11

Production Method 4

Reaction Conditions
1.1 Reagents: Trifluoroacetic acid Solvents: Dichloromethane ;  10 min, 15 °C; 3 h
Reference
Synthesis of Valganciclovir Hydrochloride Congeners
Babu, K. Srihari; Rao, M. Raghavendar; Goverdhan, G.; Srinivas, P.; Reddy, P. Pratap; et al, Synthetic Communications, 2013, 43(13), 1751-1758

Production Method 5

Reaction Conditions
1.1 Reagents: Dicyclohexylcarbodiimide Catalysts: 4-(Dimethylamino)pyridine Solvents: Dimethyl sulfoxide ;  8 h, rt
Reference
Synthesis of Valganciclovir hydrochloride and its related substances
Xu, Tao; Qu, Boyi; Hai, Li; Wu, Yong, Zhongguo Yiyao Gongye Zazhi, 2014, 45(5), 409-411

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Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:88110-89-8)O-單乙酰更昔洛韋
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Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:47
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Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:88110-89-8)O-單乙酰更昔洛韋
LE8826851
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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