Cas no 70021-45-3 (Benzo[b]thiophene,tetramethyl- (9CI))
![Benzo[b]thiophene,tetramethyl- (9CI) structure](https://ossimg.kuujia.com/scimg/70500/70021-45-3x500.png)
70021-45-3 structure
Product Name:Benzo[b]thiophene,tetramethyl- (9CI)
CAS No:70021-45-3
MF:C12H14S
MW:190.304562091827
CID:573466
PubChem ID:155356
Update Time:2025-04-19
Benzo[b]thiophene,tetramethyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzo[b]thiophene,tetramethyl- (9CI)
- 2,3,4,5-tetramethyl-1-benzothiophene
- Benzo(b)thiophene, tetramethyl-
- Tetramethylbenzo(b)thiophene
- DTXSID60220308
- 70021-45-3
- SCHEMBL2384277
-
- Inchi： 1S/C12H14S/c1-7-5-6-11-12(8(7)2)9(3)10(4)13-11/h5-6H,1-4H3
- InChI Key： YIZRQMIIWMNLIP-UHFFFAOYSA-N
- SMILES： S1C(C)=C(C)C2=C1C=CC(C)=C2C
Computed Properties
- Exact Mass: 190.08172
- Monoisotopic Mass: 190.08162162g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 190
- 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: 4.4
- Topological Polar Surface Area: 28.2?2
Experimental Properties
- PSA: 0
Benzo[b]thiophene,tetramethyl- (9CI) Related Literature
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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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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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