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90852-19-0

90852-19-0 | Bis(N-diazo)-tris(O-acetyl)-2-deoxystreptamine

CAS No: 90852-19-0 Catalog No: AG003OBF MDL No:

Product Description

Catalog Number:
AG003OBF
Chemical Name:
Bis(N-diazo)-tris(O-acetyl)-2-deoxystreptamine
CAS Number:
90852-19-0
Molecular Formula:
C12H16N6O6
Molecular Weight:
340.2920
IUPAC Name:
[(1S,3R,4S,6R)-2,3-diacetyloxy-4,6-diazidocyclohexyl] acetate
InChI:
InChI=1S/C12H16N6O6/c1-5(19)22-10-8(15-17-13)4-9(16-18-14)11(23-6(2)20)12(10)24-7(3)21/h8-12H,4H2,1-3H3/t8-,9+,10+,11-,12?
InChI Key:
SQKWPVVWVBKSIG-ZLERWKPPSA-N
SMILES:
[N-]=[N+]=N[C@@H]1C[C@H](N=[N+]=[N-])[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)C

Properties

Complexity:
567  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
340.113g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.296g/mol
Monoisotopic Mass:
340.113g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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