Cas no 69163-85-5 (Oxazole, 5-(4-bromophenyl)-2-methyl-)
69163-85-5 structure
Product Name:Oxazole, 5-(4-bromophenyl)-2-methyl-
CAS No:69163-85-5
MF:C10H8BrNO
MW:238.08062171936
CID:1736480
PubChem ID:11436331
Update Time:2025-04-21
Oxazole, 5-(4-bromophenyl)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 5-(4-bromophenyl)-2-methyl-
- MFCD27927466
- 5-(4-bromophenyl)-2-methyl-1,3-oxazole
- 69163-85-5
- 5-(4-Bromophenyl)-2-methyl-oxazole
- FXALQOQOIRCHAT-UHFFFAOYSA-N
- 5-(4-bromophenyl)-2-methyloxazole
- SCHEMBL1169513
- SY314264
- DB-123669
-
- Inchi： 1S/C10H8BrNO/c1-7-12-6-10(13-7)8-2-4-9(11)5-3-8/h2-6H,1H3
- InChI Key： FXALQOQOIRCHAT-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)C1=CN=C(C)O1
Computed Properties
- Exact Mass: 236.97894
- Monoisotopic Mass: 236.97893g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 168
- 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: 4.1
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.03
Oxazole, 5-(4-bromophenyl)-2-methyl- Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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