Cas no 24321-78-6 (thiocyanic acid, 2-cyclopentylethyl ester (8ci))
24321-78-6 structure
Product Name:thiocyanic acid, 2-cyclopentylethyl ester (8ci)
CAS No:24321-78-6
MF:C8H13NS
MW:155.26052069664
CID:913019
PubChem ID:45098413
Update Time:2025-04-19
thiocyanic acid, 2-cyclopentylethyl ester (8ci) Chemical and Physical Properties
Names and Identifiers
-
- thiocyanic acid, 2-cyclopentylethyl ester (8ci)
- 2-cyclopentylethyl thiocyanate
- 24321-78-6
- DTXSID70667689
-
- Inchi: 1S/C8H13NS/c9-7-10-6-5-8-3-1-2-4-8/h8H,1-6H2
- InChI Key: HXLLOVXHYNEUNR-UHFFFAOYSA-N
- SMILES: S(C#N)CCC1CCCC1
Computed Properties
- Exact Mass: 155.07687059g/mol
- Monoisotopic Mass: 155.07687059g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 129
- 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: 3.5
- Topological Polar Surface Area: 49.1?2
thiocyanic acid, 2-cyclopentylethyl ester (8ci) Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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