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Guanosine,2'-deoxy-(CAS No. 961-07-9)

Guanosine,2'-deoxy- C10H13N5O4 (cas 961-07-9) Molecular Structure

961-07-9 Structure

Identification and Related Records

【Name】
Guanosine,2'-deoxy-
【CAS Registry number】
961-07-9
【Synonyms】
2'-Deoxyguanosine
9H-Purin-6-ol, 2-amino-9-(2-deoxy-9-beta-D-ribofuranosyl)-
Guanine deoxyriboside
【EINECS(EC#)】
213-505-8
【Molecular Formula】
C10H13N5O4 (Products with the same molecular formula)
【Molecular Weight】
285.26
【Inchi】
InChI=1/C10H13N5O4/c11-10-13-8-7(9(18)14-10)12-3-15(8)6-1-4(17)5(2-16)19-6/h3-6,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5+,6-/m0/s1
【InChIKey】
YKBGVTZYEHREMT-UHFFFAOYSA-N
【MOL File】
961-07-9.mol

Chemical and Physical Properties

【Appearance】
white crystalline powder
【Density】
2.08g/cm3
【Melting Point】
300℃
【Boiling Point】
725.5°Cat760mmHg
【Refractive Index】
-42 ° (C=0.2, 1mol/L NaOH)
【Flash Point】
725.5°Cat760mmHg
【Stability】
Stable under normal temperatures and pressures.
【Storage temp】
Store at RT.
【Computed Properties】
Molecular Weight:267.24132 [g/mol]
Molecular Formula:C10H13N5O4
XLogP3:-1.3
H-Bond Donor:4
H-Bond Acceptor:4
Rotatable Bond Count:2
Tautomer Count:9
Exact Mass:267.096754
MonoIsotopic Mass:267.096754
Topological Polar Surface Area:135
Heavy Atom Count:19
Formal Charge:0
Complexity:417
Isotope Atom Count:0
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:4
Feature 3D Donor Count:5
Feature 3D Cation Count:1
Feature 3D Ring Count:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:23

Safety and Handling

【Hazard Codes】
Not regulated UN NO.
【Safety Statements 】
S24/25
【Transport】
OTH

Use and Manufacturing

【Usage】
Nucleoside analog

Supplier Location

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Business Type:Manufacturer
Telephone:86-10-53366563

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