Cas no 14625-58-2 (Benzoxazole,2-(3-methylphenyl)-)
14625-58-2 structure
Product Name:Benzoxazole,2-(3-methylphenyl)-
CAS No:14625-58-2
MF:C14H11NO
MW:209.243243455887
CID:233189
PubChem ID:155423
Update Time:2025-04-19
Benzoxazole,2-(3-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoxazole,2-(3-methylphenyl)-
- 2-(3-methylphenyl)-1,3-benzoxazole
- 2-m-Tolyl-benzooxazole
- 2-m-Tolylbenzoxazole
- 2-M-tolylbenzo[d]oxazole
- Benzoxazole, 2-(3-Methylphenyl)-Benzoxazole, 2-M-tolyl- (8CI)
- CS-0337194
- BB 0244263
- AB00303280
- DTXSID10163332
- AKOS000299906
- R 618
- 14625-58-2
- Benzoxazole, 2-(3-methylphenyl)-
- HMS1689B04
- CCRIS 7877
- SCHEMBL1338759
- Cambridge id 7084253
- CHEMBL401363
- 2-(3-Methylphenyl)benzoxazole
- NIOSH/DM4865161
- DM48651610
- E85913
- 2-(m-tolyl)benzo[d]oxazole
-
- Inchi： 1S/C14H11NO/c1-10-5-4-6-11(9-10)14-15-12-7-2-3-8-13(12)16-14/h2-9H,1H3
- InChI Key： PNVRWCOOQDYUJY-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2N=C1C1C=CC=C(C)C=1
Computed Properties
- Exact Mass: 209.08413
- Monoisotopic Mass: 209.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 243
- 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
- Density: 1.155
- Boiling Point: 320°Cat760mmHg
- Flash Point: 130.5°C
- Refractive Index: 1.623
- PSA: 26.03
Benzoxazole,2-(3-methylphenyl)- Related Literature
-
Wei-Can Dai,Zhong-Xia Wang Org. Chem. Front. 2017 4 1281
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