7-Deaza-2'-deoxyadenosine
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Post Date:
Feb 10,2017
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Expiry Date:
Feb 10,2018
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Detailed Description:
Cas No. :60129-59-1
Specs:97.00%
【Density】
1.75 g/cm3
【Boiling Point】
601.3 °C at 760 mmHg
【Refractive Index】
1.797
【Flash Point】
317.5 °C
【Computed Properties】
Molecular Weight:250.25386 [g/mol]
Molecular Formula:C11H14N4O3
XLogP3-AA:-0.4
H-Bond Donor:3
H-Bond Acceptor:3
Rotatable Bond Count:2
Tautomer Count:4
Exact Mass:250.10659
MonoIsotopic Mass:250.10659
Topological Polar Surface Area:106
Heavy Atom Count:18
Formal Charge:0
Complexity:306
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:3
Feature 3D Donor Count:3
Feature 3D Cation Count:3
Feature 3D Ring Count:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:25
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CAS Registry Number:
60129-59-1
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Synonyms:
;7-Deaza-2'-deoxyadenosine;7-Deaza-deoxyadenosine;
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Molecular Formula:
C11H14N4O3
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Molecular Weight:
250.2539
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Molecular Structure:
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