Cas no 141109-07-1 (Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester)
![Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester structure](https://ossimg.kuujia.com/scimg/141500/141109-07-1x500.png)
141109-07-1 structure
Product Name:Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester
CAS No:141109-07-1
MF:C25H32O6
MW:428.517988204956
CID:2676847
Update Time:2023-08-07
Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester Chemical and Physical Properties
Names and Identifiers
-
- (4-decoxyphenyl) 4-methoxycarbonyloxybenzoate
- Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester
- 4-(DECYLOXY)PHENYL 4-[(METHOXYCARBONYL)OXY]BENZOATE
-
- Inchi： 1S/C25H32O6/c1-3-4-5-6-7-8-9-10-19-29-21-15-17-22(18-16-21)30-24(26)20-11-13-23(14-12-20)31-25(27)28-2/h11-18H,3-10,19H2,1-2H3
- InChI Key： GDMVNGWYEYYRFN-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)OC(C1C=CC(=CC=1)OC(=O)OC)=O)CCCCCCCCCC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 31
- Rotatable Bond Count: 16
- Complexity: 492
- XLogP3: 8.1
- Topological Polar Surface Area: 71.1
Benzoic acid, 4-[(methoxycarbonyl)oxy]-, 4-(decyloxy)phenyl ester Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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