Cas no 66271-82-7 (Dodecane, 1-(propylthio)-)
Dodecane, 1-(propylthio)- structure
Product Name:Dodecane, 1-(propylthio)-
CAS No:66271-82-7
MF:C15H32S
MW:244.479583740234
CID:396583
PubChem ID:3660104
Update Time:2025-04-19
Dodecane, 1-(propylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Dodecane, 1-(propylthio)-
- 1-propylsulfanyldodecane
- DTXSID50394764
- 66271-82-7
- SCHEMBL10771398
- AKOS024338925
-
- Inchi: 1S/C15H32S/c1-3-5-6-7-8-9-10-11-12-13-15-16-14-4-2/h3-15H2,1-2H3
- InChI Key: JSIGETQGUMEVQW-UHFFFAOYSA-N
- SMILES: S(CCC)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 244.22266
- Monoisotopic Mass: 244.22247219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 13
- Complexity: 112
- 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: 7.4
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 0
Dodecane, 1-(propylthio)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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