Cas no 16155-94-5 (Benzoxazole,5-methyl-2-(4-methylphenyl)-)
16155-94-5 structure
Product Name:Benzoxazole,5-methyl-2-(4-methylphenyl)-
CAS No:16155-94-5
MF:C15H13NO
MW:223.269823789597
CID:177915
PubChem ID:85307
Update Time:2025-04-19
Benzoxazole,5-methyl-2-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoxazole,5-methyl-2-(4-methylphenyl)-
- 5-methyl-2-(4-methylphenyl)-1,3-benzoxazole
- 5-Methyl-2-(p-tolyl)benzoxazole
- BDBM48186
- 16155-94-5
- 5-methyl-2-(p-tolyl)-benzoxazole
- SCHEMBL3288386
- MLS000113249
- EINECS 240-308-4
- Cambridge id 7035094
- HMS2167H15
- CHEMBL234583
- SMR000109153
- cid_85307
- 5-methyl-2-(p-tolyl)-1,3-benzoxazole
- Benzoxazole, 5-methyl-2-(4-methylphenyl)-
- NS00025269
- AKOS000467707
- RETREZSKHMFVCD-UHFFFAOYSA-N
- HMS3317H20
- DTXSID2066018
- 5-methyl-2-(p-tolyl)benzo[d]oxazole
-
- Inchi： 1S/C15H13NO/c1-10-3-6-12(7-4-10)15-16-13-9-11(2)5-8-14(13)17-15/h3-9H,1-2H3
- InChI Key： RETREZSKHMFVCD-UHFFFAOYSA-N
- SMILES： O1C(C2C=CC(C)=CC=2)=NC2C=C(C)C=CC1=2
Computed Properties
- Exact Mass: 223.09979
- Monoisotopic Mass: 223.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 260
- 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
- Topological Polar Surface Area: 26A^2
- XLogP3: 4.2
Experimental Properties
- Density: 1.131
- Boiling Point: 327.9°Cat760mmHg
- Flash Point: 134.3°C
- Refractive Index: 1.613
- PSA: 26.03
Benzoxazole,5-methyl-2-(4-methylphenyl)- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
16155-94-5 (Benzoxazole,5-methyl-2-(4-methylphenyl)-) Related Products
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