Cas no 24254-59-9 (Benzenebutanoic acid,4-phenoxy-, methyl ester)
24254-59-9 structure
Product Name:Benzenebutanoic acid,4-phenoxy-, methyl ester
CAS No:24254-59-9
MF:C17H18O3
MW:270.323025226593
CID:273505
PubChem ID:141087
Update Time:2025-04-19
Benzenebutanoic acid,4-phenoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenebutanoic acid,4-phenoxy-, methyl ester
- 4-(4-Phenoxyphenyl)butanoic acid methyl ester
- methyl 4-(4-phenoxyphenyl)butanoate
- DTXSID20178952
- 24254-59-9
-
- Inchi： 1S/C17H18O3/c1-19-17(18)9-5-6-14-10-12-16(13-11-14)20-15-7-3-2-4-8-15/h2-4,7-8,10-13H,5-6,9H2,1H3
- InChI Key： VTGLGZNRGWSTHU-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C1C=CC(=CC=1)CCCC(=O)OC
Computed Properties
- Exact Mass: 270.12564
- Monoisotopic Mass: 270.126
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 276
- 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: 4.3
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 1.099
- Boiling Point: 381.3°C at 760 mmHg
- Flash Point: 160.3°C
- Refractive Index: 1.546
- PSA: 35.53
Benzenebutanoic acid,4-phenoxy-, methyl ester Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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