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5''-Deoxyuridine

CAT: 0862-GN1624-50mgSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0862-GN1624-50mgSize:50 mg
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CAS Number
15958-99-3
MDL Number
MFCD00075093
HS Code
29349990
Purity
98.00%
Molecular Formula
C9H12N2O5
Molecular Weight
228.2
Storage Conditions
-20°C
Hazardous Class
Not hazardous

Chemical Information

5'-Deoxyuridine
CAS Number15958-99-3
PubChem CID444437
IUPAC Name1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]pyrimidine-2,4-dione
Molecular FormulaC9H12N2O5
Molecular Weight228.20
XLogP-1.5
Topological Polar Surface Area99.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity356
SMILES
C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O
InChI
InChI=1S/C9H12N2O5/c1-4-6(13)7(14)8(16-4)11-3-2-5(12)10-9(11)15/h2-4,6-8,13-14H,1H3,(H,10,12,15)/t4-,6-,7-,8-/m1/s1
InChIKey
WUBAOANSQGKRHF-XVFCMESISA-N
Chemical Structure
2D Structure
2D structure of 5'-Deoxyuridine
CAS: 15958-99-3
CID: 444437
Formula: C9H12N2O5
MW: 228.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.20
XLogP3-1.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass228.07462149
Monoisotopic Mass228.07462149
Topological Polar Surface Area99.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity356
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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