Cas no 95576-34-4 (4-(4-Decylphenyl)butanoic acid)
95576-34-4 structure
Product Name:4-(4-Decylphenyl)butanoic acid
CAS No:95576-34-4
MF:C20H32O2
MW:304.466886520386
CID:2819119
Update Time:2023-08-07
4-(4-Decylphenyl)butanoic acid Chemical and Physical Properties
Names and Identifiers
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- Benzenebutanoic acid, 4-decyl-
- 4-(4-DECYLPHENYL)BUTANOIC ACID
- 4-(4-Decylphenyl)butanoic acid
-
- Inchi： 1S/C20H32O2/c1-2-3-4-5-6-7-8-9-11-18-14-16-19(17-15-18)12-10-13-20(21)22/h14-17H,2-13H2,1H3,(H,21,22)
- InChI Key： CWKRTXXBVUPMSX-UHFFFAOYSA-N
- SMILES： OC(CCCC1C=CC(=CC=1)CCCCCCCCCC)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 13
- Complexity: 267
- XLogP3: 7.2
- Topological Polar Surface Area: 37.3
4-(4-Decylphenyl)butanoic acid Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Jason Wan Lab Chip, 2020,20, 4528-4538
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