| CAS Number | 1240612-08-1 |
| Catalog Number | AG000LI2(AGN-PC-03K4FE) |
| Chemical Name | Oxazole, 2-bromo-4,5-dimethyl- |
| IUPAC Name | 2-bromo-4,5-dimethyl-1,3-oxazole |
| InChI | InChI=1S/C5H6BrNO/c1-3-4(2)8-5(6)7-3/h1-2H3 |
| InChI Key | QDVISYCNCKXBLV-UHFFFAOYSA-N |
| MDL Number | MFCD16989270 |
| Molecular Formula | C5H6BrNO |
| Molecular Weight | 176.0112 |
| SMILES | CC1=C(C)N=C(Br)O1 |
| Synonyms | 2-Bromo-4,5-dimethyloxazole,
1240612-08-1,
2-bromo-4,5-dimethyl-1,3-oxazole,
CTK5I9117,
DTXSID50622352,
Oxazole, 2-bromo-4,5-dimethyl-,
ZINC71863922,
AKOS015994846,
RP07207,
AJ-118818,
Y7293,
J-508260,
W-205186,
124061-20-7,
C5H6BrNO,
|
| Complexity | 88.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.013g/mol |
| Monoisotopic Mass | 174.963g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number