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Home > Boronic Acids > 4710-68-3
4710-68-3 | ADENOSINE-2',3'-O-PHENYLBORONATE
CAS No: 4710-68-3 Catalog No: AG00DDEO MDL No:
Product Description
Catalog Number:
AG00DDEO
Chemical Name:
ADENOSINE-2',3'-O-PHENYLBORONATE
CAS Number:
4710-68-3
IUPAC Name:
[(3aS,4R,6R)-4-(6-aminopurin-9-yl)-2-phenyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaborol-6-yl]methanol
InChI:
InChI=1S/C16H16BN5O4/c18-14-11-15(20-7-19-14)22(8-21-11)16-13-12(10(6-23)24-16)25-17(26-13)9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,23H,6H2,(H2,18,19,20)/t10-,12?,13+,16-/m1/s1
InChI Key:
AUYKHPDTEBVOAG-ZIWBQIBKSA-N
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
353.13g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
353.145g/mol
Monoisotopic Mass:
353.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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