Cas no 37135-35-6 (Benzoxazole,2-(4-ethylphenyl)-)
37135-35-6 structure
Product Name:Benzoxazole,2-(4-ethylphenyl)-
CAS No:37135-35-6
MF:C15H13NO
MW:223.269823789597
CID:296646
PubChem ID:3993383
Update Time:2025-04-19
Benzoxazole,2-(4-ethylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoxazole,2-(4-ethylphenyl)-
- 2-(4-Ethylphenyl)-1,3-benzoxazole
- 2-(4-ethylphenyl)Benzoxazole
- 2-(4-Ethyl-phenyl)-benzooxazole
- SCHEMBL11701224
- FT-0739545
- DTXSID60398430
- AKOS000452713
- 2-(4-ethylphenyl) benzoxazole
- 37135-35-6
- PWDRABLQVUHYAE-UHFFFAOYSA-N
- 2-(4-ethylphenyl)benzo[d]oxazole
- AC-20989
-
- Inchi： 1S/C15H13NO/c1-2-11-7-9-12(10-8-11)15-16-13-5-3-4-6-14(13)17-15/h3-10H,2H2,1H3
- InChI Key： PWDRABLQVUHYAE-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2N=C1C1C=CC(=CC=1)CC
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: 2
- Complexity: 247
- 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: 4.2
- Topological Polar Surface Area: 26?2
Experimental Properties
- Density: 1.129
- Boiling Point: 322.3°C at 760 mmHg
- Flash Point: 131.6°C
- Refractive Index: 1.611
- PSA: 26.03
Benzoxazole,2-(4-ethylphenyl)- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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