Adenosine, N-[(2E)-4-hydroxy-3-methyl-2-butenyl]-


Chemical Name: Adenosine, N-[(2E)-4-hydroxy-3-methyl-2-butenyl]-
CAS Number: 6025-53-2
Product Number: AG00IAO9(AGN-PC-0OD2P3)
Synonyms:
MDL No:
Molecular Formula: C15H21N5O5
Molecular Weight: 351.3577

Identification/Properties


Properties
MP:
176-179 °C
BP:
731.8°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Refractive Index:
1.7000 (estimate)
Solubility:
acetic acid: 50 mg/mL, clear, colorless
Computed Properties
Molecular Weight:
351.363g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
6
Exact Mass:
351.154g/mol
Monoisotopic Mass:
351.154g/mol
Topological Polar Surface Area:
146A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
481
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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