AG005CZA

77311-07-0 | 1-(Oxazol-2-yl)ethanone

AG005CZA

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CAS Number	77311-07-0
Catalog Number	AG005CZA(AGN-PC-02K0PM)
Chemical Name	1-(Oxazol-2-yl)ethanone
IUPAC Name	1-(1,3-oxazol-2-yl)ethanone
InChI	InChI=1S/C5H5NO2/c1-4(7)5-6-2-3-8-5/h2-3H,1H3
InChI Key	QCDUAXSWPGEYBB-UHFFFAOYSA-N
MDL Number	MFCD07699282
Molecular Formula	C5H5NO2
Molecular Weight	111.0987
SMILES	CC(C1=NC=CO1)=O
Synonyms	1-(Oxazol-2-yl)ethanone, 77311-07-0, 2-Acetyloxazole, 1-OXAZOL-2-YL-ETHANONE, 1-(1,3-OXAZOL-2-YL)ETHAN-1-ONE, 2-Acetyl oxazole, PubChem23008, SCHEMBL248292, 1-(oxazol-2-yl)ethan-1-one, AMOT0351, 1-(2-Oxazolyl)ethanone, 9CI, CTK2H5755, DTXSID40599867, ANW-47788, MFCD07699282, ZINC39067134, ETHANONE, 1-(2-OXAZOLYL)-, AKOS006227891, AB42105, AM85910, 1-(1,3-OXAZOL-2-YL)ETHANONE, AJ-97899, AK-68740, AS-32905, BR-68740, SC-49338, DB-003202, ST2415100, TC-136533, FT-0758147, W8389, S-6829, A1-01285, Z2235681137, 1- ETHANONE, C5H5NO2, Ethanone, 1-(2-oxazolyl)- (9CI),

Complexity	103
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	111.032g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	111.1g/mol
Monoisotopic Mass	111.032g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number