Cas no 1083-61-0 (4-octylsulfanylphenol)
4-octylsulfanylphenol structure
Product Name:4-octylsulfanylphenol
CAS No:1083-61-0
MF:C14H22OS
MW:238.388883113861
CID:1185437
PubChem ID:11687334
Update Time:2025-04-20
4-octylsulfanylphenol Chemical and Physical Properties
Names and Identifiers
-
- 4-octylsulfanylphenol
- CTK0D6357
- AKOS012735271
- AGN-PC-00E549
- Phenol, 4-(octylthio)-
- 4-octylthiophenol
- 4-hydroxyphenyl n-octyl sulfide
- SureCN9099086
- CTK0D6357; AKOS012735271; AGN-PC-00E549; Phenol, 4-(octylthio)-; 4-octylthiophenol; 4-hydroxyphenyl n-octyl sulfide; SureCN9099086;
- DTXSID80470621
- 1083-61-0
- SCHEMBL9099086
-
- Inchi： 1S/C14H22OS/c1-2-3-4-5-6-7-12-16-14-10-8-13(15)9-11-14/h8-11,15H,2-7,12H2,1H3
- InChI Key： BJITYLJFFTVBLZ-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)O)CCCCCCCC
Computed Properties
- Exact Mass: 238.13913649g/mol
- Monoisotopic Mass: 238.13913649g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 153
- 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: 5.5
- Topological Polar Surface Area: 45.5?2
4-octylsulfanylphenol Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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