Cas no 64909-91-7 (Benzothiazole,2-(cyclopentylmethyl)-)
64909-91-7 structure
Product Name:Benzothiazole,2-(cyclopentylmethyl)-
CAS No:64909-91-7
MF:C13H15NS
MW:217.32990193367
CID:501261
PubChem ID:45077450
Update Time:2025-04-19
Benzothiazole,2-(cyclopentylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole,2-(cyclopentylmethyl)-
- 2-Cyclopentylmethylbenzothiazole
- Benzothiazole, 2-(cyclopentylmethyl)- (9CI)
- 2-(Cyclopentylmethyl)-1,3-benzothiazole
- 64909-91-7
-
- Inchi： 1S/C13H15NS/c1-2-6-10(5-1)9-13-14-11-7-3-4-8-12(11)15-13/h3-4,7-8,10H,1-2,5-6,9H2
- InChI Key： KVMQUXDCISUHHV-UHFFFAOYSA-N
- SMILES： S1C2C=CC=CC=2N=C1CC1CCCC1
Computed Properties
- Exact Mass: 217.09265
- Monoisotopic Mass: 217.09252066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 213
- 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: 4.9
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 12.89
Benzothiazole,2-(cyclopentylmethyl)- Related Literature
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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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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
64909-91-7 (Benzothiazole,2-(cyclopentylmethyl)-) Related Products
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