AG006DBL

Name: 3-Isoxazolecarboxylic acid, 5-(1,1-dimethylethyl)-, ethyl ester
Brand: Angene Chemical
SKU: AG006DBL

91252-54-9 | 3-Isoxazolecarboxylic acid, 5-(1,1-dimethylethyl)-, ethyl ester

AG006DBL

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CAS Number	91252-54-9
Catalog Number	AG006DBL(AGN-PC-015NDA)
Chemical Name	3-Isoxazolecarboxylic acid, 5-(1,1-dimethylethyl)-, ethyl ester
IUPAC Name	ethyl 5-tert-butyl-1,2-oxazole-3-carboxylate
InChI	InChI=1S/C10H15NO3/c1-5-13-9(12)7-6-8(14-11-7)10(2,3)4/h6H,5H2,1-4H3
InChI Key	FDLIJPQDQLVOMY-UHFFFAOYSA-N
MDL Number	MFCD00085057
Molecular Formula	C10H15NO3
Molecular Weight	197.2310
SMILES	C(=O)(OCC)c1cc(on1)C(C)(C)C
Synonyms	91252-54-9, ethyl 5-tert-butylisoxazole-3-carboxylate, ethyl 5-(tert-butyl)isoxazole-3-carboxylate, ethyl 5-tert-butyl-1,2-oxazole-3-carboxylate, FDLIJPQDQLVOMY-UHFFFAOYSA-N, AK-28611, 5-tert-butyl-3-isoxazolecarboxylic acid ethyl ester, ethyl5-tert-butylisoxazole-3-carboxylate, SCHEMBL352509, CTK5G9126, DTXSID60587943, ACT10905, KS-00000G7N, ZINC2575179, ZX-AT004004, ANW-50018, MFCD00085057, SBB014613, STK691837, AKOS005603722, AS-5373, CS-W006590, MCULE-1688351254, OR29684, QC-8987, ethyl 5-t-butyl-isoxazole-3-carboxylate, AJ-42350, BR-28611, CJ-10067, SC-33419, AB0004035, AX8129130, DB-013644, ST2406964, ST4140282, TC-138763, 4CH-007296, AM20120315, FT-0652597, W9365, S-5736, A843774, C-55416, 5-tert-butylisoxazole-3-carboxylic acid ethyl ester, I02-1567, 5-tert-butyl-isoxazole-3-carboxylic acid ethyl ester, 3-Isoxazolecarboxylic acid, 5-(1,1-dimethylethyl)-, ethyl ester, C10H15NO3,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.105g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	197.234g/mol
Monoisotopic Mass	197.105g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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