Cas no 68395-78-8 (Oxazole, 2-methyl-5-(4-methylphenyl)-)
68395-78-8 structure
Product Name:Oxazole, 2-methyl-5-(4-methylphenyl)-
CAS No:68395-78-8
MF:C11H11NO
MW:173.211142778397
CID:393253
PubChem ID:12423397
Update Time:2025-04-19
Oxazole, 2-methyl-5-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2-methyl-5-(4-methylphenyl)-
- 2-methyl-5-(4-methylphenyl)-1,3-oxazole
- SCHEMBL9284900
- DTXSID00497577
- SY314269
- 68395-78-8
- MFCD30729856
- 2-Methyl-5-(p-tolyl)oxazole
-
- Inchi： 1S/C11H11NO/c1-8-3-5-10(6-4-8)11-7-12-9(2)13-11/h3-7H,1-2H3
- InChI Key： TUJNUAINMWCGSF-UHFFFAOYSA-N
- SMILES： O1C(C)=NC=C1C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 173.08413
- Monoisotopic Mass: 173.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 164
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.03
Oxazole, 2-methyl-5-(4-methylphenyl)- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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5. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
68395-78-8 (Oxazole, 2-methyl-5-(4-methylphenyl)-) Related Products
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- 852-37-9(5-phenyl-2-(4-phenylphenyl)-1,3-oxazole)
- 96829-89-9(5-phenyl-1,3-oxazole-2-carbaldehyde)
- 3969-09-3(2-methyl-5-phenyl-1,3-oxazole)
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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