7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline-5-carbonitrile;hydrochloride


Chemical Name: 7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline-5-carbonitrile;hydrochloride
CAS Number: 1187830-66-5
Product Number: AG0075BM(AGN-PC-0BGIFV)
Synonyms:
MDL No:
Molecular Formula: C11H10ClF3N2
Molecular Weight: 262.6587

Identification/Properties


Computed Properties
Molecular Weight:
262.66g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
262.048g/mol
Monoisotopic Mass:
262.048g/mol
Topological Polar Surface Area:
35.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
304
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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