AG009WTJ

Name: Dimethyl 2-(4-nitro-2-trifluoromethylphenyl)malonate
Brand: Angene Chemical
SKU: AG009WTJ

1300730-68-0 | Dimethyl 2-(4-nitro-2-trifluoromethylphenyl)malonate

AG009WTJ

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CAS Number	1300730-68-0
Catalog Number	AG009WTJ(AGN-PC-0WACVZ)
Chemical Name	Dimethyl 2-(4-nitro-2-trifluoromethylphenyl)malonate
IUPAC Name	dimethyl 2-[4-nitro-2-(trifluoromethyl)phenyl]propanedioate
InChI	InChI=1S/C12H10F3NO6/c1-21-10(17)9(11(18)22-2)7-4-3-6(16(19)20)5-8(7)12(13,14)15/h3-5,9H,1-2H3
InChI Key	UJDVQPIBEPTJNV-UHFFFAOYSA-N
MDL Number	MFCD22689081
Molecular Formula	C12H10F3NO6
Molecular Weight	321.2061
SMILES	COC(=O)C(c1ccc(cc1C(F)(F)F)[N+](=O)[O-])C(=O)OC
Synonyms	Dimethyl 2-(4-nitro-2-trifluoromethylphenyl)malonate, 1300730-68-0, C12H10F3NO6, ZINC95217823, Z9490,

Complexity	431
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	321.046g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	321.208g/mol
Monoisotopic Mass	321.046g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	98.4A^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