| CAS Number | 1196146-69-6 |
| Catalog Number | AG000PAS(AGN-PC-03JP1Z) |
| Chemical Name | 5-(Chloromethyl)-2-methyloxazole |
| IUPAC Name | 5-(chloromethyl)-2-methyl-1,3-oxazole |
| InChI | InChI=1S/C5H6ClNO/c1-4-7-3-5(2-6)8-4/h3H,2H2,1H3 |
| InChI Key | XTYVDNRUADRKQC-UHFFFAOYSA-N |
| MDL Number | MFCD13190299 |
| Molecular Formula | C5H6ClNO |
| Molecular Weight | 131.5602 |
| SMILES | CC1OC(CCl)=CN=1 |
| Synonyms | 1196146-69-6,
5-(CHLOROMETHYL)-2-METHYLOXAZOLE,
5-(CHLOROMETHYL)-2-METHYL-1,3-OXAZOLE,
SCHEMBL5833261,
ZINC95642495,
AKOS026729100,
Oxazole, 5-(chloromethyl)-2-methyl-,
AB70153,
SC-67662,
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| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.559g/mol |
| Monoisotopic Mass | 131.014g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H319
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Packing Group
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Precautionary statements
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P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number