AG007WON

Name: 3-(2-Nitro-4-Trifluoromethylphenoxy)Phenylboronic Acid
Brand: Angene Chemical
SKU: AG007WON

1072945-94-8 | 3-(2-Nitro-4-Trifluoromethylphenoxy)Phenylboronic Acid

AG007WON

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CAS Number	1072945-94-8
Catalog Number	AG007WON(AGN-PC-0WA78Y)
Chemical Name	3-(2-Nitro-4-Trifluoromethylphenoxy)Phenylboronic Acid
IUPAC Name	[3-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]boronic acid
InChI	InChI=1S/C13H9BF3NO5/c15-13(16,17)8-4-5-12(11(6-8)18(21)22)23-10-3-1-2-9(7-10)14(19)20/h1-7,19-20H
InChI Key	UYSSHRQLWIRFRP-UHFFFAOYSA-N
MDL Number	MFCD09972104
Molecular Formula	C13H9BF3NO5
Molecular Weight	327.0205
SMILES	FC(C1=CC=C(C(=C1)[N+](=O)[O-])OC1C=CC=C(B(O)O)C=1)(F)F
Synonyms	1072945-94-8, (3-(2-Nitro-4-(trifluoromethyl)phenoxy)phenyl)boronic acid, 3-(2-Nitro-4-trifluoromethylphenoxy)phenylboronic acid, 3-[2-Nitro-4-(trifluoromethyl)phenoxy]benzeneboronic acid, {3-[2-Nitro-4-(trifluoromethyl)phenoxy]phenyl}boronic acid, ACMC-2098qy, SCHEMBL2560366, CTK4A5216, DTXSID60672883, ZX-AP010437, ANW-15608, PC5681, AKOS015833513, ZINC169747443, RTR-001540, AX8229553, ST2402289, TR-001540, Z7019, A-4530, I04-1712, 3-[2-nitro-4-(trifluoromethyl)phenoxy]phenylboronic acid, C13H9BF3NO5,

Complexity	417
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	327.053g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	327.022g/mol
Monoisotopic Mass	327.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	95.5A^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