Guanosine,2'-amino-2'-deoxy- (60966-26-9)

The 2'-Amino-2'-deoxyguanosine with its cas register number is 60966-26-9. It also can be called as Guanosine, 2'-amino-2'-deoxy- and the IUPAC Name about this chemical is 2-amino-9-[(2R,3R,4S,5R)-3-amino-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one.

Physical properties about 2'-Amino-2'-deoxyguanosine are: (1)ACD/LogP: -1.16; (2)# of Rule of 5 Violations: 2; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 2.31; (7)#H bond acceptors: 10; (8)#H bond donors: 7; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 84.66Ų; (11)Index of Refraction: 1.985; (12)Molar Refractivity: 61.87 cm³; (13)Molar Volume: 124.9 cm³; (14)Polarizability: 24.54x10^-24cm³; (15)Surface Tension: 127.6 dyne/cm; (16)Enthalpy of Vaporization: 115.2 kJ/mol; (17)Vapour Pressure: 7.53E-24 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=NC2=C(N1C3C(C(C(O3)CO)O)N)NC(=NC2=O)N
(2)Isomeric SMILES: C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)N)NC(=NC2=O)N
(3)InChI: InChI=1S/C10H14N6O4/c11-4-6(18)3(1-17)20-9(4)16-2-13-5-7(16)14-10(12)15-8(5)19/h2-4,6,9,17-18H,1,11H2,(H3,12,14,15,19)/t3-,4-,6-,9-/m1/s1
(4)InChIKey: ROPTVRLUGSPXNH-DXTOWSMRSA-N

The toxicity data is as follows: