AG00IF58

885273-42-7 | 2-methyl-1,3-oxazole-5-carbaldehyde

AG00IF58

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CAS Number	885273-42-7
Catalog Number	AG00IF58(AGN-PC-05FKQF)
Chemical Name	2-methyl-1,3-oxazole-5-carbaldehyde
IUPAC Name	2-methyl-1,3-oxazole-5-carbaldehyde
InChI	InChI=1S/C5H5NO2/c1-4-6-2-5(3-7)8-4/h2-3H,1H3
InChI Key	GMUISAQLYQMSAN-UHFFFAOYSA-N
MDL Number	MFCD06738689
Molecular Formula	C5H5NO2
Molecular Weight	111.0987
SMILES	CC=1OC(=CN1)C=O
Synonyms	2-Methyloxazole-5-carbaldehyde, 885273-42-7, 153138-05-7, 2-methyl-1,3-oxazole-5-carbaldehyde, 2-METHYL-OXAZOLE-5-CARBALDEHYDE, 5-Oxazolecarboxaldehyde,2-methyl-, ion(1-), ACMC-1C4TV, SCHEMBL17925712, 2-methyl-5-oxazolecarboxaldehyde, CTK4C7718, KS-00000JZV, 4199AC, ANW-69447, BBL100236, CM-382, MFCD06738689, STL553807, ZINC20443735, AKOS005255694, AB27658, CS-W021727, RP19001, AJ-77692, CS-13017, SC-14501, SC-65844, DB-081332, ST2404505, TC-060159, FT-0650274, Z-5563, A809394, J-510073, 4-bromo-3-nitropyridine, C5H5NO2, ACN-044977, 2-Chloro-N-(4,5,6-trifluoro-benzothiazol-2-yl)-acetamide, 23056-44-2,

Complexity	94.4
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	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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