AG006ZBP

Name: 4,5-Dimethyl-2-nitrobenzoic acid
Brand: Angene Chemical
SKU: AG006ZBP

4315-14-4 | 4,5-Dimethyl-2-nitrobenzoic acid

AG006ZBP

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CAS Number	4315-14-4
Catalog Number	AG006ZBP(AGN-PC-00JOHY)
Chemical Name	4,5-Dimethyl-2-nitrobenzoic acid
IUPAC Name	4,5-dimethyl-2-nitrobenzoic acid
InChI	InChI=1S/C9H9NO4/c1-5-3-7(9(11)12)8(10(13)14)4-6(5)2/h3-4H,1-2H3,(H,11,12)
InChI Key	XGXYTCSDJADEGC-UHFFFAOYSA-N
MDL Number	MFCD09264530
Molecular Formula	C9H9NO4
Molecular Weight	195.1721
SMILES	CC1=C(C)C=C([N+]([O-])=O)C(C(O)=O)=C1
Synonyms	4,5-DIMETHYL-2-NITROBENZOIC ACID, 4315-14-4, 4,5-Dimethyl-2-nitro-benzoic acid, 3,4-dimethyl-6-nitrobenzoic acid, SCHEMBL8137115, CTK1C8172, DTXSID50475668, 5968AB, ANW-57572, BBL100528, MFCD09264530, STL554322, ZINC71792952, AKOS005254371, Benzoic acid, 4,5-dimethyl-2-nitro-, 3,4-DIMETHYL-6-NITROBENZOICACID, AS-47172, SC-43287, AJ-118738, DB-070409, TX-016623, FT-0687097, ST24025321, Z-5021, C9H9NO4, Methyl 4,5-dimethyl-2-nitrobenzoate, ACN-045050, 90922-74-0,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.053g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	195.174g/mol
Monoisotopic Mass	195.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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