Cas no 19728-43-9 (Benzenethiol,2,4-bis(1,1-dimethylethyl)-)
19728-43-9 structure
Product Name:Benzenethiol,2,4-bis(1,1-dimethylethyl)-
CAS No:19728-43-9
MF:C14H22S
MW:222.389482975006
CID:123724
PubChem ID:519681
Update Time:2025-04-18
Benzenethiol,2,4-bis(1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenethiol,2,4-bis(1,1-dimethylethyl)-
- 2,4-Di-tert-butylbenzenethiol
- 2,4-DI-TERT-BUTYLTHIOPHENOL
- 2,4-Ditert-butylbenzenethiol
- 2,4-Ditert-butylbenzenethiol #
- SCHEMBL7086864
- 19728-43-9
- DTXSID40334114
- FT-0610223
- 2,4-di-t-butylthiophenol
- ACJAQOIIEMFTGS-UHFFFAOYSA-N
-
- Inchi： 1S/C14H22S/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3
- InChI Key： ACJAQOIIEMFTGS-UHFFFAOYSA-N
- SMILES： SC1=CC=C(C=C1C(C)(C)C)C(C)(C)C
Computed Properties
- Exact Mass: 222.14436
- Monoisotopic Mass: 222.14422188g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 206
- 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
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: 5.4
- Topological Polar Surface Area: 1?2
Experimental Properties
- PSA: 0
Benzenethiol,2,4-bis(1,1-dimethylethyl)- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
19728-43-9 (Benzenethiol,2,4-bis(1,1-dimethylethyl)-) Related Products
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