Cas no 920510-68-5 (1,2-Dithiolane-3-pentanamide, N-hexyl-)
920510-68-5 structure
Product Name:1,2-Dithiolane-3-pentanamide, N-hexyl-
CAS No:920510-68-5
MF:C14H27NOS2
MW:289.500281572342
CID:747655
PubChem ID:71422734
Update Time:2025-04-19
1,2-Dithiolane-3-pentanamide, N-hexyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Dithiolane-3-pentanamide, N-hexyl-
- 5-(dithiolan-3-yl)-N-hexylpentanamide
- DTXSID60841739
- SCHEMBL19786736
- 920510-68-5
- 5-(1,2-DITHIOLAN-3-YL)-N-HEXYLPENTANAMIDE
-
- Inchi： 1S/C14H27NOS2/c1-2-3-4-7-11-15-14(16)9-6-5-8-13-10-12-17-18-13/h13H,2-12H2,1H3,(H,15,16)
- InChI Key： HSEPNJRXPWMKQB-UHFFFAOYSA-N
- SMILES： S1C(CCS1)CCCCC(NCCCCCC)=O
Computed Properties
- Exact Mass: 289.15340683g/mol
- Monoisotopic Mass: 289.15340683g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 10
- Complexity: 224
- 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: 3.8
- Topological Polar Surface Area: 79.7?2
1,2-Dithiolane-3-pentanamide, N-hexyl- Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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