AG0079F7

Name: 5-Bromo-4-thiocyanato-2-(trifluoromethoxy)aniline
Brand: Angene Chemical
SKU: AG0079F7

1133115-30-6 | 5-Bromo-4-thiocyanato-2-(trifluoromethoxy)aniline

AG0079F7

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CAS Number	1133115-30-6
Catalog Number	AG0079F7(AGN-PC-0WAB79)
Chemical Name	5-Bromo-4-thiocyanato-2-(trifluoromethoxy)aniline
IUPAC Name	[4-amino-2-bromo-5-(trifluoromethoxy)phenyl] thiocyanate
InChI	InChI=1S/C8H4BrF3N2OS/c9-4-1-5(14)6(15-8(10,11)12)2-7(4)16-3-13/h1-2H,14H2
InChI Key	WPSWDDCBPNXWHN-UHFFFAOYSA-N
MDL Number	MFCD11855818
Molecular Formula	C8H4BrF3N2OS
Molecular Weight	313.0944
SMILES	N#CSc1cc(OC(F)(F)F)c(cc1Br)N
Synonyms	5-BROMO-4-THIOCYANATO-2-(TRIFLUOROMETHOXY)ANILINE, 1133115-30-6, C8H4BrF3N2OS, ACMC-2099hy, CTK4A8204, DTXSID60674928, ANW-16580, MFCD11855818, ZINC38537366, AKOS015834028, RTR-002534, TR-002534, Z7416, A-4969, I09-2125, 4-Amino-2-bromo-5-(trifluoromethoxy)phenyl thiocyanate,

Complexity	293
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	311.918g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	313.092g/mol
Monoisotopic Mass	311.918g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	84.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

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