Home Carboxys Methyl-beta-D-ribofuranosyl-1,2,4-triazole-3-carboxylate

Methyl-beta-D-ribofuranosyl-1,2,4-triazole-3-carboxylate

CAS No.:
38934-69-9
Catalog Number:
AG00C91A
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C91A
Chemical Name:
Methyl-beta-D-ribofuranosyl-1,2,4-triazole-3-carboxylate
CAS Number:
38934-69-9
MDL Number:
MFCD09751040
IUPAC Name:
methyl 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carboxylate
InChI:
InChI=1S/C9H13N3O6/c1-17-9(16)7-10-3-12(11-7)8-6(15)5(14)4(2-13)18-8/h3-6,8,13-15H,2H2,1H3
InChI Key:
RFJYLFZDYHCYNF-UHFFFAOYSA-N
NSC Number:
360639
Properties
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.08g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
259.218g/mol
Monoisotopic Mass:
259.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties