AG000LQG

Name: 2-T-Butyl-3-Hydroxy-6-Trifluoromethylisoindolin-1-One
Brand: Angene Chemical
SKU: AG000LQG

1242336-60-2 | 2-T-Butyl-3-Hydroxy-6-Trifluoromethylisoindolin-1-One

AG000LQG

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CAS Number	1242336-60-2
Catalog Number	AG000LQG(AGN-PC-09PZHB)
Chemical Name	2-T-Butyl-3-Hydroxy-6-Trifluoromethylisoindolin-1-One
IUPAC Name	2-tert-butyl-3-hydroxy-6-(trifluoromethyl)-3H-isoindol-1-one
InChI	InChI=1S/C13H14F3NO2/c1-12(2,3)17-10(18)8-5-4-7(13(14,15)16)6-9(8)11(17)19/h4-6,10,18H,1-3H3
InChI Key	VHSMYVDQIMNFGA-UHFFFAOYSA-N
MDL Number	MFCD17015811
Molecular Formula	C13H14F3NO2
Molecular Weight	273.2510
SMILES	O=C1N(C(C)(C)C)C(O)C2=C1C=C(C(F)(F)F)C=C2
Synonyms	1242336-60-2, 2-(tert-Butyl)-3-hydroxy-6-(trifluoromethyl)isoindolin-1-one, 2-T-BUTYL-3-HYDROXY-6-TRIFLUOROMETHYLISOINDOLIN-1-ONE, ACMC-209ar7, CTK4B3803, DTXSID50682138, ANW-18209, MFCD17015811, AKOS015838013, AK-94631, AX8231516, TR-035028, ST24021914, Z8758, B-2588, I10-902, 2-tert-Butyl-3-hydroxy-6-(trifluoromethyl)-2,3-dihydro-1H-isoindol-1-one, 1H-Isoindol-1-one, 2-(1,1-dimethylethyl)-2,3-dihydro-3-hydroxy-6-(trifluoromethyl)-, C13H14F3NO2, VHSMYVDQIMNFGA-UHFFFAOYSA-N,

Complexity	375
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.098g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	273.255g/mol
Monoisotopic Mass	273.098g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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