Cas no 7641-84-1 (Ethanone, 1-[4-(1-methylbutyl)phenyl]-)
![Ethanone, 1-[4-(1-methylbutyl)phenyl]- structure](https://ossimg.kuujia.com/scimg/8000/7641-84-1x500.png)
7641-84-1 structure
Product Name:Ethanone, 1-[4-(1-methylbutyl)phenyl]-
Ethanone, 1-[4-(1-methylbutyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-[4-(1-methylbutyl)phenyl]-
- 1-(4-pentan-2-ylphenyl)ethanone
- (+-)-1-[4-(1-Methyl-butyl)-phenyl]-aethanon
- (+-)-1-[4-(1-methyl-butyl)-phenyl]-ethanone
- 1-[4-(1-Methyl-butyl)-phenyl]-aethanon
- 1-[4-(pentan-2-yl)phenyl]ethanone
- 4-sec.Pentyl-acetophenon
- AC1L6SCM
- CTK2I0779
- NSC169243
- 1-[4-(Pentan-2-yl)phenyl]ethan-1-one
- 7641-84-1
- SCHEMBL11600900
- NSC-169243
- DTXSID00305148
-
- Inchi： 1S/C13H18O/c1-4-5-10(2)12-6-8-13(9-7-12)11(3)14/h6-10H,4-5H2,1-3H3
- InChI Key： GEQWROJEPWBTOP-UHFFFAOYSA-N
- SMILES： O=C(C)C1C=CC(=CC=1)C(C)CCC
Computed Properties
- Exact Mass: 190.13584
- Monoisotopic Mass: 190.135765193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 178
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.1
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
- LogP: 3.79280
Ethanone, 1-[4-(1-methylbutyl)phenyl]- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
7641-84-1 (Ethanone, 1-[4-(1-methylbutyl)phenyl]-) Related Products
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