AG0014S0

Name: Methyl 2-nitro-5-(trifluoromethyl)benzoate
Brand: Angene Chemical
SKU: AG0014S0

1214324-86-3 | Methyl 2-nitro-5-(trifluoromethyl)benzoate

AG0014S0

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CAS Number	1214324-86-3
Catalog Number	AG0014S0(AGN-PC-0WD37Y)
Chemical Name	Methyl 2-nitro-5-(trifluoromethyl)benzoate
IUPAC Name	methyl 2-nitro-5-(trifluoromethyl)benzoate
InChI	InChI=1S/C9H6F3NO4/c1-17-8(14)6-4-5(9(10,11)12)2-3-7(6)13(15)16/h2-4H,1H3
InChI Key	NPNQVXRWDIMHDX-UHFFFAOYSA-N
MDL Number	MFCD14698080
Molecular Formula	C9H6F3NO4
Molecular Weight	249.1434
SMILES	COC(=O)C1=CC(=CC=C1[N+]([O-])=O)C(F)(F)F
Synonyms	Methyl 2-nitro-5-(trifluoromethyl)benzoate, 1214324-86-3, DTXSID90596543, MFCD14698080, ZINC47202454, PC53206, AS-35773, AJ-110642, AX8260076, Benzoic acid, 2-nitro-5-(trifluoromethyl)-, methyl ester,

Complexity	312
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.025g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	249.145g/mol
Monoisotopic Mass	249.025g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

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