AG003RWC

33545-41-4 | Methyl 5-(furan-2-yl)isoxazole-3-carboxylate

AG003RWC

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CAS Number	33545-41-4
Catalog Number	AG003RWC(AGN-PC-0LOLCI)
Chemical Name	Methyl 5-(furan-2-yl)isoxazole-3-carboxylate
IUPAC Name	methyl 5-(furan-2-yl)-1,2-oxazole-3-carboxylate
InChI	InChI=1S/C9H7NO4/c1-12-9(11)6-5-8(14-10-6)7-3-2-4-13-7/h2-5H,1H3
InChI Key	VTEZSUGFQUZAQW-UHFFFAOYSA-N
MDL Number	MFCD03778977
Molecular Formula	C9H7NO4
Molecular Weight	193.1562
SMILES	O=C(C1=NOC(C2=CC=CO2)=C1)OC
Synonyms	33545-41-4, methyl 5-(2-furyl)isoxazole-3-carboxylate, methyl 5-(furan-2-yl)isoxazole-3-carboxylate, methyl 5-(furan-2-yl)-1,2-oxazole-3-carboxylate, AC1NQ3N6, SCHEMBL4129575, KS-00000BLP, DTXSID80410522, VTEZSUGFQUZAQW-UHFFFAOYSA-N, ZINC6857893, 7086AJ, MFCD03778977, STK342121, AKOS003314441, MCULE-8627756798, TRA0062437, AJ-56944, AK-83942, DA-18219, DS-17346, SY015180, Methyl5-(2-Furyl)isoxazole-3-carboxylate, AB0058791, TC-308549, FT-0768229, ST24047958, ST50656861, L-4156, MFCD03778977 (97+%), 5-(2-Furyl)-3-isoxazolecarboxylic acid methyl ester, F2135-0561, Z1123417128, C9H7NO4, CID5214769, Methyl 5-(2-furyl)-1,2-oxazole-3-carboxylate, 1453-58-3,

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.038g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	193.158g/mol
Monoisotopic Mass	193.038g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	65.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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