AG01A43W

Name: methyl 2,4,6-trimethyl-3-nitrobenzoate
Brand: Angene Chemical
SKU: AG01A43W

250650-97-6 | methyl 2,4,6-trimethyl-3-nitrobenzoate

AG01A43W

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CAS Number	250650-97-6
Catalog Number	AG01A43W
Chemical Name	methyl 2,4,6-trimethyl-3-nitrobenzoate
IUPAC Name	methyl 2,4,6-trimethyl-3-nitrobenzoate
InChI	InChI=1S/C11H13NO4/c1-6-5-7(2)10(12(14)15)8(3)9(6)11(13)16-4/h5H,1-4H3
InChI Key	QZDCQHUTGCJJJT-UHFFFAOYSA-N
MDL Number	MFCD12172977
Molecular Formula	C11H13NO4
Molecular Weight	223.2252
SMILES	COC(C1=C(C)C([N+]([O-])=O)=C(C)C=C1C)=O
Synonyms	methyl 2,4,6-trimethyl-3-nitrobenzoate, 250650-97-6, 2,4,6-trimethyl-3-nitro-benzoic acid methyl ester, ZINC35333469, NE25283, CID10561037, Methyl 2,4,6-trimethyl-3-nitro-benzoate,

Complexity	286
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.084g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	223.228g/mol
Monoisotopic Mass	223.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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