Cas no 156136-67-3 (2H-Indole-2-thione,1,3-dihydro-1,6-dimethyl-)
156136-67-3 structure
Product Name:2H-Indole-2-thione,1,3-dihydro-1,6-dimethyl-
CAS No:156136-67-3
MF:C10H11NS
MW:177.266041040421
CID:107271
PubChem ID:10241355
Update Time:2025-04-18
2H-Indole-2-thione,1,3-dihydro-1,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Indole-2-thione,1,3-dihydro-1,6-dimethyl-
- SCHEMBL8999088
- DTXSID301262682
- 156136-67-3
- 1,6-dimethyl-3H-indole-2-thione
- 1,6-Dimethylindoline-2-thione
- 2H-Indole-2-thione, 1,3-dihydro-1,6-dimethyl-
- 1,3-Dihydro-1,6-dimethyl-2H-indole-2-thione
-
- Inchi： 1S/C10H11NS/c1-7-3-4-8-6-10(12)11(2)9(8)5-7/h3-5H,6H2,1-2H3
- InChI Key： OSNMWSIWAZUHAQ-UHFFFAOYSA-N
- SMILES： S=C1CC2C=CC(C)=CC=2N1C
Computed Properties
- Exact Mass: 177.06133
- Monoisotopic Mass: 177.06122053g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 202
- 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: 1.9
- Topological Polar Surface Area: 35.3?2
Experimental Properties
- PSA: 3.24
2H-Indole-2-thione,1,3-dihydro-1,6-dimethyl- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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