Home Other Building Blocks 2-Chloroinosine 3’,4’,6’-Triacetate

2-Chloroinosine 3’,4’,6’-Triacetate

CAS No.:
41623-86-3
Catalog Number:
AG00C92L
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C92L
Chemical Name:
2-Chloroinosine 3’,4’,6’-Triacetate
CAS Number:
41623-86-3
MDL Number:
MFCD28898713
IUPAC Name:
[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(2-chloro-6-oxo-1H-purin-9-yl)oxolan-2-yl]methyl acetate
InChI:
InChI=1S/C16H17ClN4O8/c1-6(22)26-4-9-11(27-7(2)23)12(28-8(3)24)15(29-9)21-5-18-10-13(21)19-16(17)20-14(10)25/h5,9,11-12,15H,4H2,1-3H3,(H,19,20,25)/t9-,11-,12-,15-/m1/s1
InChI Key:
DOMXKCPDQAYHFE-SDBHATRESA-N
Properties
Complexity:
746  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
428.073g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
428.782g/mol
Monoisotopic Mass:
428.073g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties