Cas no 26524-87-8 (1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide)
26524-87-8 structure
Product Name:1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide
CAS No:26524-87-8
MF:C10H12OS
MW:180.266681671143
CID:288823
PubChem ID:345957
Update Time:2025-04-19
1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- 1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide
- 2,3,4,5-tetrahydro-1λ<sup>4</sup>-benzothiepine 1-oxide
- AC1L83WN
- Homothiachroman-1-oxid
- NSC403934
- SureCN1376881
- tetrahydrobenzothiepine-1-oxide
- OETQCLHKWUINEL-UHFFFAOYSA-N
- 26524-87-8
- NSC-403934
- DTXSID00323403
- SCHEMBL1376881
-
- Inchi： 1S/C10H12OS/c11-12-8-4-3-6-9-5-1-2-7-10(9)12/h1-2,5,7H,3-4,6,8H2
- InChI Key： OETQCLHKWUINEL-UHFFFAOYSA-N
- SMILES： S1(C2C=CC=CC=2CCCC1)=O
Computed Properties
- Exact Mass: 180.06096
- Monoisotopic Mass: 180.061
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 179
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 36.3?2
Experimental Properties
- Density: 1.22
- Boiling Point: 357.3°Cat760mmHg
- Flash Point: 169.9°C
- Refractive Index: 1.626
- PSA: 17.07
- LogP: 2.99620
1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide Related Literature
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
26524-87-8 (1-Benzothiepin,2,3,4,5-tetrahydro-, 1-oxide) Related Products
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
