AG00126D

136663-23-5 | Methyl 2-methylbenzo[d]oxazole-6-carboxylate

AG00126D

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CAS Number	136663-23-5
Catalog Number	AG00126D(AGN-PC-0NHYTV)
Chemical Name	Methyl 2-methylbenzo[d]oxazole-6-carboxylate
IUPAC Name	methyl 2-methyl-1,3-benzoxazole-6-carboxylate
InChI	InChI=1S/C10H9NO3/c1-6-11-8-4-3-7(10(12)13-2)5-9(8)14-6/h3-5H,1-2H3
InChI Key	CIGMBXJEQUHKPR-UHFFFAOYSA-N
MDL Number	MFCD00113064
Molecular Formula	C10H9NO3
Molecular Weight	191.1834
SMILES	COC(=O)C1=CC2=C(C=C1)N=C(C)O2
Synonyms	Methyl 2-methylbenzo[d]oxazole-6-carboxylate, 136663-23-5, Methyl 2-methyl-1,3-benzoxazole-6-carboxylate, SCHEMBL1680291, CTK8B9155, DTXSID60478781, CIGMBXJEQUHKPR-UHFFFAOYSA-N, ZINC2157903, ANW-62112, MFCD00113064, methyl 2-methylbenzoxazole-6 carboxylate, Methyl 2-Methylbenzoxazole-6-carboxylate, AJ-33689, CJ-07808, SY108684, TC-150857, CS-0063936, FT-0723559, V2658, MFCD00113064 (95%), 2-Methylbenzoxazole-6-carboxylic acid methyl ester, 2-methyl-benzooxazole-6-carboxylic acid methyl ester, 2-Methyl-benzoxazole-6-carboxylic acid methyl ester, 6-Benzoxazolecarboxylic acid, 2-methyl-, methyl ester, C10H9NO3, Methyl2-methylbenzo[d]oxazole-6-carboxylate,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	191.186g/mol
Monoisotopic Mass	191.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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