Cas no 105163-69-7 (Pyridine,4-[2-(octylthio)ethyl]-)
![Pyridine,4-[2-(octylthio)ethyl]- structure](https://ossimg.kuujia.com/scimg/105500/105163-69-7x500.png)
105163-69-7 structure
Product Name:Pyridine,4-[2-(octylthio)ethyl]-
CAS No:105163-69-7
MF:C15H25NS
MW:251.430702924728
CID:159860
PubChem ID:3064641
Update Time:2025-04-19
Pyridine,4-[2-(octylthio)ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine,4-[2-(octylthio)ethyl]-
- 4-(2-octylsulfanylethyl)pyridine
- 1-octyl 2-(4-pyridyl)ethyl sulfide
- 4-(2-(Octylthio)ethyl)pyridine
- AC1MI887
- BRN 4803195
- LS-131873
- Pyridine, 4-(2-(octylthio)ethyl)-
- DTXSID40146991
- 105163-69-7
-
- Inchi： 1S/C15H25NS/c1-2-3-4-5-6-7-13-17-14-10-15-8-11-16-12-9-15/h8-9,11-12H,2-7,10,13-14H2,1H3
- InChI Key： HVFZVBQLNUNAAG-UHFFFAOYSA-N
- SMILES： S(CCC1C=CN=CC=1)CCCCCCCC
Computed Properties
- Exact Mass: 251.17095
- Monoisotopic Mass: 251.17077098g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 10
- Complexity: 155
- 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: 5.2
- Topological Polar Surface Area: 38.2?2
Experimental Properties
- PSA: 12.89
Pyridine,4-[2-(octylthio)ethyl]- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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