AG003RY6

51677-09-9 | Methyl 5-phenylisoxazole-3-carboxylate

AG003RY6

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CAS Number	51677-09-9
Catalog Number	AG003RY6(AGN-PC-0JXW4T)
Chemical Name	Methyl 5-phenylisoxazole-3-carboxylate
IUPAC Name	methyl 5-phenyl-1,2-oxazole-3-carboxylate
InChI	InChI=1S/C11H9NO3/c1-14-11(13)9-7-10(15-12-9)8-5-3-2-4-6-8/h2-7H,1H3
InChI Key	XMPLCJOQBDGMKT-UHFFFAOYSA-N
MDL Number	MFCD02159553
Molecular Formula	C11H9NO3
Molecular Weight	203.1941
SMILES	O=C(C1=NOC(C2=CC=CC=C2)=C1)OC
Synonyms	Methyl 5-phenylisoxazole-3-carboxylate, 51677-09-9, 5-Phenyl-isoxazole-3-carboxylic acid methyl ester, Methyl 5-phenyl-3-isoxazolecarboxylate, methyl 5-phenyl-1,2-oxazole-3-carboxylate, 5-PHENYL-3-ISOXAZOLECARBOXYLIC ACID METHYL ESTER, XMPLCJOQBDGMKT-UHFFFAOYSA-N, 3-Isoxazolecarboxylic acid, 5-phenyl-, methyl ester, F1727-0213, AC1LIKG2, AC1Q5ZLQ, ChemDiv2_001475, SCHEMBL69157, MLS000528812, ARONIS24022, methylphenylisoxazolecarboxylate, CHEMBL1562885, CTK4J4681, KS-00000BLR, DTXSID10358625, HMS1373D01, HMS2322H18, WT694, ZINC487561, CS-D0327, ANW-49999, BBL012364, MFCD02159553, SBB009684, STK327861, Methyl5-Phenylisoxazole-3-carboxylate, AKOS000271391, MCULE-7720754593, MP-0477, RP11846, TRA0028507, KS-000046H3, AJ-23139, AK-35426, BAS 06491645, CJ-04290, SC-87098, SMR000121287, SY015189, ZB014155, AB0025229, TR-018408, 4CH-006702, AM20040607, FT-0647861, ST24031149, ST45053204, W6653, AZ0001-0261, MFCD02159553 (97+%), 11Z-0717, 3-Isoxazolecarboxylicacid, 5-phenyl-, methyl ester, J-522510, Methyl 5-phenylisoxazole-3-carboxylate, AldrichCPR, 51677-09-9 methyl 5-phenylisoxazole-3-carboxylate, I14-20199, C11H9NO3, AR-1J5590, CID905953, ZINC00487561, 51971-46-1,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.197g/mol
Monoisotopic Mass	203.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

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