(2R,3S,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydrochloride


Chemical Name: (2R,3S,9aR)-2-(hydroxymethyl)-6-imino-2,3,3a,9a-tetrahydrofuro[1,2][1,3]oxazolo[3,4-a]pyrimidin-3-ol;hydrochloride
CAS Number: 10212-25-6
Product Number: AG00H9R2(AGN-PC-00IQQB)
Synonyms:
MDL No: MFCD00012636
Molecular Formula: C9H12ClN3O4
Molecular Weight: 261.6623

Identification/Properties


Computed Properties
Molecular Weight:
261.662g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
261.052g/mol
Monoisotopic Mass:
261.052g/mol
Topological Polar Surface Area:
98.4A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
394
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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