4-Amino-2,6-dimethyl-8-(2'-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone supplier

Name
4-Amino-2,6-dimethyl-8-(2’-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone
EINECS
CAS No. 195442-56-9
Density 1.759 g/cm³
Solubility
Melting Point >190°C dec.
Formula C₁₃H₁₇N₅O₄
Boiling Point 621.605 °C at 760 mmHg
Molecular Weight 307.3052
Flash Point 329.735 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,6-dimethyl-pteridin-7-one;
PSA
LogP

4-Amino-2,6-dimethyl-8-(2'-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone Specification

The CAS registry number of 4-Amino-2,6-dimethyl-8-(2'-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone is 195442-56-9. This chemical's molecular formula is C₁₃H₁₇N₅O₄ and molecular weight is 307.3052. What's more, its systematic name is called 4-Amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,6-dimethyl-pteridin-7-one. A highly fluorescent adenosine analogue, which in a dimethoxytrityl, phosphoramidite protected form, can be site-specifically inserted into oligonucleotides through a 3’,5’-phosphodiester linkage using an automated DNA synthesizer.

Physical properties about 4-Amino-2,6-dimethyl-8-(2'-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 4.072; (5)ACD/KOC (pH 7.4): 12.675; (6)#H bond acceptors: 9; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 134.16 Å²; (10)Index of Refraction: 1.782; (11)Molar Refractivity: 73.416 cm³; (12)Molar Volume: 174.683 cm³; (13)Surface Tension: 74.732 dyne/cm; (14)Density: 1.759 g/cm³; (15)Flash Point: 329.735 °C; (16)Enthalpy of Vaporization: 96.82 kJ/mol; (17)Boiling Point: 621.605 °C at 760 mmHg; (18)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1c(=O)n(c2c(n1)c(nc(n2)C)N)[C@H]3C[C@H]([C@H](O3)CO)O
(2) InChI: InChI=1/C13H17N5O4/c1-5-13(21)18(9-3-7(20)8(4-19)22-9)12-10(15-5)11(14)16-6(2)17-12/h7-9,19-20H,3-4H2,1-2H3,(H2,14,16,17)/t7-,8-,9-/m1/s1
(3) InChIKey: MJVDCGSSLDHUHZ-IWSPIJDZBC

Product Name

4-Amino-2,6-dimethyl-8-(2’-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone

4-Amino-2,6-dimethyl-8-(2'-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone Specification

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