Home Other Building Blocks 2-O-ETHYLTHYMIDINE

2-O-ETHYLTHYMIDINE

CAS No.:
59495-21-5
Catalog Number:
AG00EBC7
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00EBC7
Chemical Name:
2-O-ETHYLTHYMIDINE
CAS Number:
59495-21-5
MDL Number:
MFCD00800199
IUPAC Name:
2-ethoxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-4-one
InChI:
InChI=1S/C12H18N2O5/c1-3-18-12-13-11(17)7(2)5-14(12)10-4-8(16)9(6-15)19-10/h5,8-10,15-16H,3-4,6H2,1-2H3/t8-,9+,10+/m0/s1
InChI Key:
ALVZYWVHJVQICM-IVZWLZJFSA-N
Properties
Complexity:
420  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
270.122g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.285g/mol
Monoisotopic Mass:
270.122g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Analysis of ethylated thymidine adducts in human leukocyte DNA by stable isotope dilution nanoflow liquid chromatography-nanospray ionization tandem mass spectrometry. Analytical chemistry 20120306
Properties