Cas no 182344-58-7 (Benzothiazole,2-chloro-4-propyl-)
182344-58-7 structure
Product Name:Benzothiazole,2-chloro-4-propyl-
CAS No:182344-58-7
MF:C10H10ClNS
MW:211.711100101471
CID:113838
PubChem ID:22125393
Update Time:2025-04-18
Benzothiazole,2-chloro-4-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole,2-chloro-4-propyl-
- Benzothiazole, 2-chloro-4-propyl- (9CI)
- SCHEMBL8097167
- 2-Chloro-4-propyl-1,3-benzothiazole
- QDQVWTYVFYTZTD-UHFFFAOYSA-N
- 2-chloro-4-propylbenzothiazole
- 182344-58-7
-
- Inchi： 1S/C10H10ClNS/c1-2-4-7-5-3-6-8-9(7)12-10(11)13-8/h3,5-6H,2,4H2,1H3
- InChI Key： QDQVWTYVFYTZTD-UHFFFAOYSA-N
- SMILES： ClC1=NC2=C(C=CC=C2CCC)S1
Computed Properties
- Exact Mass: 211.0224
- Monoisotopic Mass: 211.022
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 176
- 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: 4.7
- Topological Polar Surface Area: 41.1A^2
Experimental Properties
- PSA: 12.89
Benzothiazole,2-chloro-4-propyl- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
182344-58-7 (Benzothiazole,2-chloro-4-propyl-) Related Products
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- 79050-49-0(4,5-dimethyl-1,3-benzothiazol-2-amine)
- 131395-10-3(2-Amino-6-(tert-butyl)benzothiazole)
- 394223-38-2(1,3-benzothiazole-5-carbaldehyde)
- 499770-92-2(6-(Aminomethyl)benzothiazole)
- 120546-67-0(6,7,8,9-Tetrahydrothiazolo4,5-hisoquinoline)
- 1477-42-5(4-methyl-1,3-benzothiazol-2-amine)
- 2268-79-3(6-Methyl-2-mercaptobenzothiazole)
- 120546-71-6(Thiazolo[5,4-h]isoquinolin-2(1H)-one,6,7,8,9-tetrahydro-)
- 157764-01-7(2-(4-Methylbenzo[d]thiazol-2-yl)acetonitrile)
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