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3'-Deoxy-5-methyluridine

CAT: 0926-ND02776-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0926-ND02776-01Size:10 mg
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CAS Number
7084-29-9
Synonyms
5-Methyl-3'-deoxyuridine;3'-Deoxy-5-methyl-D-uridine;5'-Methyl-3'-deoxyuridine
MDL Number
MFCD01631052
Smiles
CC1=CN (C (=O) NC1=O) [C@H]2[C@@H] (C[C@H] (O2) CO) O
Molecular Formula
C10H14N2O5
Molecular Weight
242.23 g/mol
Controlled
No

Chemical Information

5-Methyl-3'-deoxyuridine
CAS Number7084-29-9
PubChem CID9881284
IUPAC Name1-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Molecular FormulaC10H14N2O5
Molecular Weight242.23
XLogP-1.5
Topological Polar Surface Area99.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity381
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2[C@@H](C[C@H](O2)CO)O
InChI
InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-8(5)15)9-7(14)2-6(4-13)17-9/h3,6-7,9,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,9+/m0/s1
InChIKey
UYUWZFRYAAHPDN-LKEWCRSYSA-N
Chemical Structure
2D Structure
2D structure of 5-Methyl-3'-deoxyuridine
CAS: 7084-29-9
CID: 9881284
Formula: C10H14N2O5
MW: 242.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight242.23
XLogP3-1.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass242.09027155
Monoisotopic Mass242.09027155
Topological Polar Surface Area99.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity381
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes