1-Hydroxy-2,7-diamino Mitosene (Mixture cis/trans)


Chemical Name: 1-Hydroxy-2,7-diamino Mitosene (Mixture cis/trans)
CAS Number: 1192552-64-9
Product Number: AG008X3J(AGN-PC-0WAGRL)
Synonyms:
MDL No:
Molecular Formula: C14H16N4O5
Molecular Weight: 320.30064

Identification/Properties


Computed Properties
Molecular Weight:
320.305g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
320.112g/mol
Monoisotopic Mass:
320.112g/mol
Topological Polar Surface Area:
164A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
618
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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