AG01BGGI

Name: 5-Methyl-3-(o-tolyl)isoxazole-4-carboxylic acid
Brand: Angene Chemical
SKU: AG01BGGI

91569-58-3 | 5-Methyl-3-(o-tolyl)isoxazole-4-carboxylic acid

AG01BGGI

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CAS Number	91569-58-3
Catalog Number	AG01BGGI(AGN-PC-04FNNV)
Chemical Name	5-Methyl-3-(o-tolyl)isoxazole-4-carboxylic acid
IUPAC Name	5-methyl-3-(2-methylphenyl)-1,2-oxazole-4-carboxylic acid
InChI	InChI=1S/C12H11NO3/c1-7-5-3-4-6-9(7)11-10(12(14)15)8(2)16-13-11/h3-6H,1-2H3,(H,14,15)
InChI Key	CBOGMXJKUKBSEQ-UHFFFAOYSA-N
MDL Number	MFCD07376088
Molecular Formula	C12H11NO3
Molecular Weight	217.2206
SMILES	CC1=C(C(O)=O)C(C2=C(C)C=CC=C2)=NO1
Synonyms	91569-58-3, 5-methyl-3-(o-tolyl)isoxazole-4-carboxylic acid, 5-Methyl-3-(2-methylphenyl)-1,2-oxazole-4-carboxylic acid, SCHEMBL12457425, CTK3I6038, DTXSID00640541, ZINC16746085, AKOS013476379, 4-Isoxazolecarboxylicacid, 5-methyl-3-(2-methylphenyl)-, F1907-0513, Z1946684553, 4-Isoxazolecarboxylic acid, 5-methyl-3-o-tolyl- (7CI),

Complexity	269
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.074g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	217.224g/mol
Monoisotopic Mass	217.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
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