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195442-55-8

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Basic Information
CAS No.: 195442-55-8
Name: 4-Amino-6-methyl-8-(2-deoxy-b-D-ribofuranosyl)-7(8H)-pteridone
Article Data: 1
Molecular Structure:
Molecular Structure of 195442-55-8 (4-Amino-6-methyl-8-(2-deoxy-b-D-ribofuranosyl)-7(8H)-pteridone)
Formula: C12H15N5O4
Molecular Weight: 293.28
Synonyms: 4-Amino-6-methyl-8-(2-deoxy-beta-D-ribofuranosyl)-7(8H)-pteridone;4-Amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methyl-pteridin-7-one;4-Amino-6-methyl-8-(2-deoxy-?2-D-ribofuranosyl)-7(8H)-pteridone;
Density: 1.839 g/cm3
Melting Point: >190°C dec.
Boiling Point: 644.412 °C at 760 mmHg
Flash Point: 343.528 °C
Appearance: Cyrstalline solid
PSA: 136.38000
LogP: -0.70100
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Specification

The 4-Amino-6-methyl-8-(2-deoxy-b-D-ribofuranosyl)-7(8H)-pteridone with CAS registry number of 195442-55-8 is also known as 4-Amino-6-methyl-8-(2-deoxy-beta-D-ribofuranosyl)-7(8H)-pteridone. The systematic name is 4-Amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methyl-pteridin-7-one. It belongs to product categories of Bases & Related Reagents; Fluorescent Labels & Indicators; Nucleotides. In addition, the formula is C12H15N5O4 and the molecular weight is 293.28. What's more, this chemical is a cyrstalline solid and a highly fluorescent adenosine analogue.

Physical properties about 4-Amino-6-methyl-8-(2-deoxy-b-D-ribofuranosyl)-7(8H)-pteridone are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 10.742; (4)ACD/KOC (pH 7.4): 11.64; (5)#H bond acceptors: 9; (6)#H bond donors: 4; (7)#Freely Rotating Bonds: 4; (8)Index of Refraction: 1.813; (9)Molar Refractivity: 68.992 cm3; (10)Molar Volume: 159.472 cm3; (11)Surface Tension: 83.807 dyne/cm; (12)Density: 1.839 g/cm3; (13)Flash Point: 343.528 °C; (14)Enthalpy of Vaporization: 99.915 kJ/mol; (15)Boiling Point: 644.412 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
1. SMILES: Cc1c(=O)n(c2c(n1)c(ncn2)N)[C@H]3C[C@H]([C@H](O3)CO)O
2. InChI: InChI=1/C12H15N5O4/c1-5-12(20)17(8-2-6(19)7(3-18)21-8)11-9(16-5)10(13)14-4-15-11/h4,6-8,18-19H,2-3H2,1H3,(H2,13,14,15)/t6-,7-,8-/m1/s1
3. InChIKey: MHIOPDSMXLCBHH-BWZBUEFSBS
4. Std. InChI: InChI=1S/C12H15N5O4/c1-5-12(20)17(8-2-6(19)7(3-18)21-8)11-9(16-5)10(13)14-4-15-11/h4,6-8,18-19H,2-3H2,1H3,(H2,13,14,15)/t6-,7-,8-/m1/s1
5. Std. InChIKey: MHIOPDSMXLCBHH-BWZBUEFSSA-N