Home Sulfos [3-methanesulfonyl-5-(trifluoromethyl)phenyl]methanamine hydrochloride

[3-methanesulfonyl-5-(trifluoromethyl)phenyl]methanamine hydrochloride

CAS No.:
1803598-05-1
Catalog Number:
AG01B9DV
Molecular Formula:
C9H11ClF3NO2S
Molecular Weight:
289.7023
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Product Description
Catalog Number:
AG01B9DV
Chemical Name:
[3-methanesulfonyl-5-(trifluoromethyl)phenyl]methanamine hydrochloride
CAS Number:
1803598-05-1
Molecular Formula:
C9H11ClF3NO2S
Molecular Weight:
289.7023
MDL Number:
MFCD28383831
IUPAC Name:
[3-methylsulfonyl-5-(trifluoromethyl)phenyl]methanamine;hydrochloride
InChI:
InChI=1S/C9H10F3NO2S.ClH/c1-16(14,15)8-3-6(5-13)2-7(4-8)9(10,11)12;/h2-4H,5,13H2,1H3;1H
InChI Key:
GPWXOGZEDRGZHC-UHFFFAOYSA-N
SMILES:
NCc1cc(cc(c1)S(=O)(=O)C)C(F)(F)F.Cl
Properties
Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.015g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
289.697g/mol
Monoisotopic Mass:
289.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties