AG00BJ3M

Name: 4-Bromo-2-(trifluoromethyl)thioanisole
Brand: Angene Chemical
SKU: AG00BJ3M

300356-31-4 | 4-Bromo-2-(trifluoromethyl)thioanisole

AG00BJ3M

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CAS Number	300356-31-4
Catalog Number	AG00BJ3M(AGN-PC-03NVBT)
Chemical Name	4-Bromo-2-(trifluoromethyl)thioanisole
IUPAC Name	4-bromo-1-methylsulfanyl-2-(trifluoromethyl)benzene
InChI	InChI=1S/C8H6BrF3S/c1-13-7-3-2-5(9)4-6(7)8(10,11)12/h2-4H,1H3
InChI Key	KMADDVSNZFTXEC-UHFFFAOYSA-N
MDL Number	MFCD15527239
Molecular Formula	C8H6BrF3S
Molecular Weight	271.0974
SMILES	CSc1ccc(cc1C(F)(F)F)Br
Synonyms	300356-31-4, 4-Bromo-1-(methylthio)-2-(trifluoromethyl)-benzene, 4-Bromo-2-(trifluoromethyl)thioanisole, 4-bromo-2-(trifluoromethyl)phenyl methyl sulfide, 4-Bromo-1-(methylthio)-2-(trifluoromethyl)benzene, SCHEMBL710314, KMADDVSNZFTXEC-UHFFFAOYSA-N, MFCD15527239, ZINC90413307, AKOS026673650, Z0490, Q-8353, 4-bromo-1-methylsulfanyl-2-trifluoromethyl-benzene, C8H6BrF3S,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	269.933g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	271.095g/mol
Monoisotopic Mass	269.933g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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