| CAS Number | 1803612-22-7 |
| Catalog Number | AG01B8G2 |
| Chemical Name | tert-butyl N-{[3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}carbamate |
| IUPAC Name | tert-butyl N-[[3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]carbamate |
| InChI | InChI=1S/C17H24N2O3/c1-11-6-7-13(8-12(11)2)15-9-14(22-19-15)10-18-16(20)21-17(3,4)5/h6-8,14H,9-10H2,1-5H3,(H,18,20) |
| InChI Key | KKPSBLMEUDTRKD-UHFFFAOYSA-N |
| MDL Number | MFCD28348077 |
| Molecular Formula | C17H24N2O3 |
| Molecular Weight | 304.3841 |
| SMILES | CC1=C(C)C=C(C2CC(CNC(OC(C)(C)C)=O)ON=2)C=C1 |
| Synonyms | tert-butyl N-{[3-(3,4-dimethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}carbamate,
1803612-22-7,
AKOS033731239,
Z2011450812,
|
| Complexity | 428 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.39g/mol |
| Monoisotopic Mass | 304.179g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 59.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Lot Number