Cas no 1444368-20-0 (5-chloro-2-(2-ethylbutoxy)benzaldehyde)
1444368-20-0 structure
Product Name:5-chloro-2-(2-ethylbutoxy)benzaldehyde
CAS No:1444368-20-0
MF:C13H17ClO2
MW:240.725883245468
CID:2132655
Update Time:2023-11-19
5-chloro-2-(2-ethylbutoxy)benzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 5-chloro-2-(2-ethylbutoxy)Benzaldehyde
- QZUGUWSSLSAFJH-UHFFFAOYSA-N
- 5-Chloro-2-(2-ethyl-butoxy)-benzaldehyde
- CID 82926311
- Benzaldehyde, 5-chloro-2-(2-ethylbutoxy)-
- 5-chloro-2-(2-ethylbutoxy)benzaldehyde
-
- Inchi： 1S/C13H17ClO2/c1-3-10(4-2)9-16-13-6-5-12(14)7-11(13)8-15/h5-8,10H,3-4,9H2,1-2H3
- InChI Key： QZUGUWSSLSAFJH-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C=O)C=1)OCC(CC)CC
Computed Properties
- Exact Mass: 240.092
- Monoisotopic Mass: 240.092
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 204
- 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: 26.3
Experimental Properties
- Density: 1.094±0.06 g/cm3(Predicted)
- Boiling Point: 334.3±22.0 °C(Predicted)
5-chloro-2-(2-ethylbutoxy)benzaldehyde Related Literature
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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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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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