AG00IUEP

Name: 2-(Isopropylsulfanyl)-6-(trifluoromethyl)nicotinonitrile
Brand: Angene Chemical
SKU: AG00IUEP

478050-38-3 | 2-(Isopropylsulfanyl)-6-(trifluoromethyl)nicotinonitrile

AG00IUEP

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CAS Number	478050-38-3
Catalog Number	AG00IUEP(AGN-PC-0WAUOY)
Chemical Name	2-(Isopropylsulfanyl)-6-(trifluoromethyl)nicotinonitrile
IUPAC Name	2-propan-2-ylsulfanyl-6-(trifluoromethyl)pyridine-3-carbonitrile
InChI	InChI=1S/C10H9F3N2S/c1-6(2)16-9-7(5-14)3-4-8(15-9)10(11,12)13/h3-4,6H,1-2H3
InChI Key	BERFWSWURUMXLH-UHFFFAOYSA-N
MDL Number	MFCD01815519
Molecular Formula	C10H9F3N2S
Molecular Weight	246.2521
SMILES	S(C1(=NC(=CC=C1C#N)C(F)(F)F))C(C)C
Synonyms	478050-38-3, 2-(isopropylsulfanyl)-6-(trifluoromethyl)nicotinonitrile, 2-(propan-2-ylsulfanyl)-6-(trifluoromethyl)pyridine-3-carbonitrile, AC1NC707, 2-propan-2-ylsulfanyl-6-(trifluoromethyl)pyridine-3-carbonitrile, KS-00001XS1, ZINC4052771, MFCD01815519, AKOS005093885, 5P-318S, MCULE-3692016434, CID4529177,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	246.044g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	246.251g/mol
Monoisotopic Mass	246.044g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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