AG00I4TM

Name: 4-(Methylsulphonyl)-3-(trifluoromethyl)aniline
Brand: Angene Chemical
SKU: AG00I4TM

252561-92-5 | 4-(Methylsulphonyl)-3-(trifluoromethyl)aniline

AG00I4TM

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CAS Number	252561-92-5
Catalog Number	AG00I4TM(AGN-PC-0WRAB3)
Chemical Name	4-(Methylsulphonyl)-3-(trifluoromethyl)aniline
IUPAC Name	4-methylsulfonyl-3-(trifluoromethyl)aniline
InChI	InChI=1S/C8H8F3NO2S/c1-15(13,14)7-3-2-5(12)4-6(7)8(9,10)11/h2-4H,12H2,1H3
InChI Key	MDHRVGGGCCSPMR-UHFFFAOYSA-N
MDL Number	MFCD12807191
Molecular Formula	C8H8F3NO2S
Molecular Weight	239.2148
SMILES	CS(=O)(=O)c1ccc(cc1C(F)(F)F)N
Synonyms	252561-92-5, 4-(Methylsulfonyl)-3-(trifluoromethyl)aniline, 4-(Methylsulphonyl)-3-(trifluoromethyl)aniline, 4-methanesulfonyl-3-(trifluoromethyl)aniline, SCHEMBL4639494, CTK7D6251, MDHRVGGGCCSPMR-UHFFFAOYSA-N, KS-00003R3W, ZX-AP003505, MFCD12807191, PC6125, SBB099076, ZINC37754451, AKOS010149230, PS-7600, 5-Amino-2-(methylsulphonyl)benzotrifluoride, 4-(methylsulfonyl)-3-(trifluoromethyl)phenylamine, 4-Amino-2-(trifluoromethyl)phenyl methyl sulphone,

Complexity	320
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.023g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	239.212g/mol
Monoisotopic Mass	239.023g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited