Cas no 781599-99-3 (Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl-)
![Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl- structure](https://ossimg.kuujia.com/scimg/782000/781599-99-3x500.png)
781599-99-3 structure
Product Name:Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl-
CAS No:781599-99-3
MF:C13H22N2
MW:206.327183246613
CID:553874
PubChem ID:18373605
Update Time:2025-04-19
Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl-
- Tricyclo[3.3.1.13,7]decane-1-carboximidamide, 3-ethyl- (9CI)
- 3-ethyladamantane-1-carboximidamide
- 3-Ethyltricyclo[3.3.1.1~3,7~]decane-1-carboximidamide
- DTXSID70593217
- 781599-99-3
-
- Inchi： 1S/C13H22N2/c1-2-12-4-9-3-10(5-12)7-13(6-9,8-12)11(14)15/h9-10H,2-8H2,1H3,(H3,14,15)
- InChI Key： NCGVACGZMFYCCY-UHFFFAOYSA-N
- SMILES： NC(C12CC3CC(C1)CC(CC)(C3)C2)=N
Computed Properties
- Exact Mass: 206.178298710g/mol
- Monoisotopic Mass: 206.178298710g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 294
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 49.9?2
Tricyclo[3.3.1.13,7]decane-1-carboximidamide,3-ethyl- Related Literature
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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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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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