AG00DIVO

Name: 3-Methoxy-4-(trifluoromethyl)benzonitrile
Brand: Angene Chemical
SKU: AG00DIVO

447-93-8 | 3-Methoxy-4-(trifluoromethyl)benzonitrile

AG00DIVO

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CAS Number	447-93-8
Catalog Number	AG00DIVO(AGN-PC-0WAOV3)
Chemical Name	3-Methoxy-4-(trifluoromethyl)benzonitrile
IUPAC Name	3-methoxy-4-(trifluoromethyl)benzonitrile
InChI	InChI=1S/C9H6F3NO/c1-14-8-4-6(5-13)2-3-7(8)9(10,11)12/h2-4H,1H3
InChI Key	QASUCJMIPAXDOB-UHFFFAOYSA-N
MDL Number	MFCD13185685
Molecular Formula	C9H6F3NO
Molecular Weight	201.1452
SMILES	O(C)c1c(C(F)(F)F)ccc(C#N)c1
Synonyms	3-methoxy-4-(trifluoromethyl)benzonitrile, 447-93-8, MFCD13185685, SCHEMBL3571001, ZINC91252355, AKOS015957220, FCH1380723, JS-5009, PC302851, 3-Methoxy-4-(trifluoromethyl)-benzonitrile, Benzonitrile, 3-methoxy-4-(trifluoromethyl)-,

Complexity	242
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.04g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	201.148g/mol
Monoisotopic Mass	201.04g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	33A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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