Cas no 96429-66-2 (9-((2,3-dihydroxy-1-propoxy)methyl)guanine)
96429-66-2 structure
Product Name:9-((2,3-dihydroxy-1-propoxy)methyl)guanine
CAS No:96429-66-2
MF:C9H13N5O4
MW:255.230621099472
CID:806722
PubChem ID:135446919
Update Time:2025-04-19
9-((2,3-dihydroxy-1-propoxy)methyl)guanine Chemical and Physical Properties
Names and Identifiers
-
- 9-((2,3-dihydroxy-1-propoxy)methyl)guanine
- 3-((2-AMINO-6-HYDROXY-9H-PURIN-9-YL)METHOXY)-1,2-PROPANEDIOL
- UNII-NNJ00018WY
- 2-AMINO-9-((2,3-DIHYDROXYPROPOXY)METHYL)-1,9-DIHYDRO-6H-PURIN-6-ONE
- 6H-PURIN-6-ONE, 2-AMINO-9-((2,3-DIHYDROXYPROPOXY)METHYL)-1,9-DIHYDRO-
- SCHEMBL7760398
- DTXSID80914515
- 2-Amino-9-(((2RS)-2,3-dihydroxypropoxy)methyl)-1,9-dihydro-6H-purin-6-one
- CHEMBL169549
- GANCICLOVIR IMPURITY E [EP IMPURITY]
- 2-Amino-9-(2,3-dihydroxy-propoxymethyl)-1,9-dihydro-purin-6-one
- 86357-09-7
- 96429-66-2
- Iso Ganciclovir
- (+/-)-2-AMINO-9-((2,3-DIHYDROXYPROPOXY)METHYL)-1,9-DIHYDRO-6H-PURIN-6-ONE
- FT-0670461
- 3-[(6-Hydroxy-2-imino-2,3-dihydro-9H-purin-9-yl)methoxy]propane-1,2-diol
- 2-Amino-9-((2,3-dihydroxypropoxy)methyl)-1H-purin-6(9H)-one
- 9-(2,3-dihydroxy-1-propoxymethyl)guanine
- Isoganciclovir
- Q27284968
- Ganciclovir Specified Impurity E [EP]
- 2-amino-9-(2,3-dihydroxypropoxymethyl)-1H-purin-6-one
- 2-amino-9-((2,3-dihydroxypropoxy)methyl)-3H-purin-6(9H)-one? (Ganciclovir Impurity pound(c)
- CS-0163969
- (RS)-2-AMINO-9-(2,3-DIHYDROXY-PROPOXYMETHYL)-1,9-DIHYDRO-PURIN-6-ONE
- NNJ00018WY
- (+/-)-iNDG
- iso-Ganciclovir
- YMJRISBBXAOKCD-UHFFFAOYSA-N
-
- Inchi： 1S/C9H13N5O4/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-2-5(16)1-15/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17)
- InChI Key： YMJRISBBXAOKCD-UHFFFAOYSA-N
- SMILES： O(CC(CO)O)CN1C=NC2C(NC(N)=NC1=2)=O
Computed Properties
- Exact Mass: 255.097
- Monoisotopic Mass: 255.097
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 350
- 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
- XLogP3: _2.2
- Topological Polar Surface Area: 135A^2
Experimental Properties
- Density: 1.81
- Boiling Point: 689.6°Cat760mmHg
- Flash Point: 370.8°C
- Refractive Index: 1.76
9-((2,3-dihydroxy-1-propoxy)methyl)guanine Related Literature
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
96429-66-2 (9-((2,3-dihydroxy-1-propoxy)methyl)guanine) Related Products
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