ALLO-1


Chemical Name: ALLO-1
CAS Number: 37468-32-9
Product Number: AG00C9PP(AGN-PC-0WAG01)
Synonyms:
MDL No:
Molecular Formula: C17H15ClN2O2
Molecular Weight: 314.7662

Identification/Properties


Computed Properties
Molecular Weight:
314.769g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
314.082g/mol
Monoisotopic Mass:
314.082g/mol
Topological Polar Surface Area:
40.6A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
428
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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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