Proline, 5-oxo-, pentachlorophenyl ester


Chemical Name: Proline, 5-oxo-, pentachlorophenyl ester
CAS Number: 28990-85-4
Product Number: AG002V4O(AGN-PC-0O8MXT)
Synonyms:
MDL No:
Molecular Formula: C11H6Cl5NO3
Molecular Weight: 377.4352

Identification/Properties


Computed Properties
Molecular Weight:
377.423g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
376.876g/mol
Monoisotopic Mass:
374.879g/mol
Topological Polar Surface Area:
55.4A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
394
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
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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