Thymidine, 2',3'-didehydro-3'-deoxy-, 5'-benzoate


Chemical Name: Thymidine, 2',3'-didehydro-3'-deoxy-, 5'-benzoate
CAS Number: 122567-97-9
Product Number: AG0080M1(AGN-PC-0O0FW0)
Synonyms:
MDL No:
Molecular Formula: C17H16N2O5
Molecular Weight: 328.3193

Identification/Properties


Computed Properties
Molecular Weight:
328.324g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
328.106g/mol
Monoisotopic Mass:
328.106g/mol
Topological Polar Surface Area:
84.9A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
592
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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