Cas no 215778-81-7 (Thiazole,4-(chloromethyl)-2-(4-pentylphenyl)-)
215778-81-7 structure
Product Name:Thiazole,4-(chloromethyl)-2-(4-pentylphenyl)-
CAS No:215778-81-7
MF:C15H18ClNS
MW:279.82812166214
CID:243177
PubChem ID:2774102
Update Time:2025-04-19
Thiazole,4-(chloromethyl)-2-(4-pentylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Thiazole,4-(chloromethyl)-2-(4-pentylphenyl)-
- 4-(CHLOROMETHYL)-2-(4-PENTYLPHENYL)-1,3-THIAZOLE
- AC1MCNXT
- AG-E-58116
- CTK4E7180
- FT-0616722
- KB-187469
- OR21046
- 215778-81-7
- SCHEMBL12531837
- 4-(Chloromethyl)-2-(4-pentylphenyl)thiazole
- DTXSID10378883
-
- Inchi： 1S/C15H18ClNS/c1-2-3-4-5-12-6-8-13(9-7-12)15-17-14(10-16)11-18-15/h6-9,11H,2-5,10H2,1H3
- InChI Key： CLYMMYUMRHKSNK-UHFFFAOYSA-N
- SMILES： ClCC1=CSC(C2C=CC(=CC=2)CCCCC)=N1
Computed Properties
- Exact Mass: 279.08500
- Monoisotopic Mass: 279.0848484g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 229
- 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: 5.5
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- Density: 1.13
- Melting Point: 59 °C
- Boiling Point: 406.4°Cat760mmHg
- Flash Point: 199.6°C
- Refractive Index: 1.564
- PSA: 41.13000
- LogP: 5.28160
Thiazole,4-(chloromethyl)-2-(4-pentylphenyl)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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