| CAS Number | 159015-07-3 |
| Catalog Number | AG001QF6(AGN-PC-0030BP) |
| Chemical Name | 2-Oxazolecarboxaldehyde, 4-Methyl- |
| IUPAC Name | 4-methyl-1,3-oxazole-2-carbaldehyde |
| InChI | InChI=1S/C5H5NO2/c1-4-3-8-5(2-7)6-4/h2-3H,1H3 |
| InChI Key | WQFUYXRLSRTPKS-UHFFFAOYSA-N |
| MDL Number | MFCD10700246 |
| Molecular Formula | C5H5NO2 |
| Molecular Weight | 111.0987 |
| SMILES | CC1N=C(C=O)OC=1 |
| Synonyms | 159015-07-3,
2-Oxazolecarboxaldehyde, 4-methyl-,
4-METHYLOXAZOLE-2-CARBALDEHYDE,
4-METHYL-1,3-OXAZOLE-2-CARBALDEHYDE,
4-Methyl-oxazole-2-carbaldehyde,
SCHEMBL7467485,
CTK0E6991,
DTXSID10565433,
FCH882572,
MFCD10700246,
ZINC20443719,
AKOS006302302,
PB28183,
QC-9493,
4-METHYL-2-OXAZOLECARBOXALDEHYDE,
AK164865,
AS-50741,
CS-0055282,
Z-7633,
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| 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
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Certificate of Analysis
Lot Number