4, 5- Dihydro- 4, 4- dimethyl- 2- (2- methylphenyl) oxazole - CAS 71885-44-4
Catalog: |
BB067718 |
Product Name: |
4, 5- Dihydro- 4, 4- dimethyl- 2- (2- methylphenyl) oxazole |
CAS: |
71885-44-4 |
Synonyms: |
4,4-Dimethyl-2-(o-tolyl)-4,5-dihydrooxazole; 4,4-dimethyl-2-(2-methylphenyl)-5H-1,3-oxazole; 4,5-DIHYDRO-4,4-DIMETHYL-2-O-TOLYLOXAZOLE; 4,4-Dimethyl-2-(2-methylphenyl)-4,5-dihydro-1,3-oxazole; 4,5-Dihydro-4,4-dimethyl-2-(2-methylphenyl)oxazole; 4,5-Dihydro-4,4-dimethyl-2-[2-methylphenyl]oxazole; 2-o-Tolyl-4,4-dimethyl-2-oxazoline |
IUPAC Name: | 4,4-dimethyl-2-(2-methylphenyl)-5H-1,3-oxazole |
Description: | 4,5-Dihydro-4,4-dimethyl-2-(2-methylphenyl) Oxazole is an intermediate in the synthesis of NRPE a pigment that forms during the visual cycle in vertebrates leading to harmful byproducts of this biosynthetic pathway. |
Molecular Weight: | 189.25 |
Molecular Formula: | C12H15NO |
Canonical SMILES: | CC1=CC=CC=C1C2=NC(CO2)(C)C |
InChI: | InChI=1S/C12H15NO/c1-9-6-4-5-7-10(9)11-13-12(2,3)8-14-11/h4-7H,8H2,1-3H3 |
InChI Key: | XOMMHEIXGWIETI-UHFFFAOYSA-N |
Solubility: | Chloroform, Methanol |
Appearance: | Yellow Oil |
Complexity: | 245 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.115364102 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 21.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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