AG019EXP

Name: Ethyl 5-bromo-4-methylbenzo[d]isoxazole-3-carboxylate
Brand: Angene Chemical
SKU: AG019EXP

854015-42-2 | Ethyl 5-bromo-4-methylbenzo[d]isoxazole-3-carboxylate

AG019EXP

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CAS Number	854015-42-2
Catalog Number	AG019EXP
Chemical Name	Ethyl 5-bromo-4-methylbenzo[d]isoxazole-3-carboxylate
IUPAC Name	ethyl 5-bromo-4-methyl-1,2-oxazole-3-carboxylate
InChI	InChI=1S/C7H8BrNO3/c1-3-11-7(10)5-4(2)6(8)12-9-5/h3H2,1-2H3
InChI Key	JDEKAKGYNNXSLB-UHFFFAOYSA-N
MDL Number	MFCD28661157
Molecular Formula	C7H8BrNO3
Molecular Weight	234.0473
SMILES	O=C(OCC)C1=NOC(Br)=C1C
Synonyms	ethyl 5-bromo-4-methylisoxazole-3-carboxylate, 854015-42-2, SCHEMBL766573, JDEKAKGYNNXSLB-UHFFFAOYSA-N, ZINC114544455, 5-bromo-4-methyl-isoxazole-3-carboxylic acid ethyl ester, 3-Isoxazolecarboxylic acid, 5-bromo-4-methyl-, ethyl ester,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.96876g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.05g/mol
Monoisotopic Mass	232.96876g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3Å²
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