3-Chloro-2-iodo-4-(trifluoromethoxy)aniline


Chemical Name: 3-Chloro-2-iodo-4-(trifluoromethoxy)aniline
CAS Number: 1792885-92-7
Product Number: AG0026WT(AGN-PC-0WAMEY)
Synonyms:
MDL No: MFCD28753342
Molecular Formula: C7H4ClF3INO
Molecular Weight: 337.4654

Identification/Properties


Computed Properties
Molecular Weight:
337.465g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
336.898g/mol
Monoisotopic Mass:
336.898g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
204
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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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