Cas no 53544-82-4 (Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)-)
53544-82-4 structure
Product Name:Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)-
CAS No:53544-82-4
MF:C15H10N2S2
MW:282.383300304413
CID:357017
PubChem ID:71365174
Update Time:2025-04-19
Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)-
- 6-isothiocyanato-2-(4-methylphenyl)-1,3-benzothiazole
- DTXSID70788601
- 53544-82-4
-
- Inchi： 1S/C15H10N2S2/c1-10-2-4-11(5-3-10)15-17-13-7-6-12(16-9-18)8-14(13)19-15/h2-8H,1H3
- InChI Key： MAMHRAKBNXFZTA-UHFFFAOYSA-N
- SMILES： S1C2C=C(C=CC=2N=C1C1C=CC(C)=CC=1)N=C=S
Computed Properties
- Exact Mass: 282.0287
- Monoisotopic Mass: 282.02854067g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 359
- 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: 6
- Topological Polar Surface Area: 85.6?2
Experimental Properties
- PSA: 25.25
Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)- Related Literature
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
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
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
53544-82-4 (Benzothiazole, 6-isothiocyanato-2-(4-methylphenyl)-) Related Products
- 6392-97-8(6-Benzothiazolamine,2-phenyl-)
- 6278-73-5(4-(1,3-Benzothiazol-2-yl)aniline)
- 154851-85-1(6-Benzothiazolamine,2-(4-pyridinyl)-)
- 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)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 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)
Recommended suppliers
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier
CN Supplier
Bulk
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier
CN Supplier
Bulk
