AG00I01B

Name: 3-Cyano-5-(trifluoromethoxy)phenylboronic acid, pinacol ester
Brand: Angene Chemical
SKU: AG00I01B

1803321-00-7 | 3-Cyano-5-(trifluoromethoxy)phenylboronic acid, pinacol ester

AG00I01B

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CAS Number	1803321-00-7
Catalog Number	AG00I01B(AGN-PC-0WOC7D)
Chemical Name	3-Cyano-5-(trifluoromethoxy)phenylboronic acid, pinacol ester
IUPAC Name	3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethoxy)benzonitrile
InChI	InChI=1S/C14H15BF3NO3/c1-12(2)13(3,4)22-15(21-12)10-5-9(8-19)6-11(7-10)20-14(16,17)18/h5-7H,1-4H3
InChI Key	MJJRQGMWICLSNN-UHFFFAOYSA-N
MDL Number	MFCD18756761
Molecular Formula	C14H15BF3NO3
Molecular Weight	313.0800
SMILES	N#Cc1cc(cc(c1)OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Synonyms	1803321-00-7, 3-Cyano-5-(trifluoromethoxy)phenylboronic acid, pinacol ester, 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethoxy)benzonitrile, MFCD18756761, ZINC169956041, B-9676,

Complexity	456
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	313.11g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	313.083g/mol
Monoisotopic Mass	313.11g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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