N-Acetyl-6-chloro-D-tryptophan


Chemical Name: N-Acetyl-6-chloro-D-tryptophan
CAS Number: 56777-76-5
Product Number: AG00EEFQ(AGN-PC-0OCFPW)
Synonyms:
MDL No:
Molecular Formula: C13H13ClN2O3
Molecular Weight: 280.70692

Identification/Properties


Computed Properties
Molecular Weight:
280.708g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
280.061g/mol
Monoisotopic Mass:
280.061g/mol
Topological Polar Surface Area:
82.2A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
364
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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