Cas no 20422-02-0 (1H-Azepine, 1-hexylhexahydro-)
1H-Azepine, 1-hexylhexahydro- structure
Product Name:1H-Azepine, 1-hexylhexahydro-
CAS No:20422-02-0
MF:C12H25N
MW:183.333603620529
CID:1393677
PubChem ID:12905717
Update Time:2025-04-20
1H-Azepine, 1-hexylhexahydro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Azepine, 1-hexylhexahydro-
- 1-hexylazepane
- 20422-02-0
- 1-hexyl-azepane
- N-hexylhexahydroazepine
- DTXSID20512635
- SCHEMBL4655516
-
- Inchi： 1S/C12H25N/c1-2-3-4-7-10-13-11-8-5-6-9-12-13/h2-12H2,1H3
- InChI Key： CNAVQNCUXDPHPV-UHFFFAOYSA-N
- SMILES： N1(CCCCCC)CCCCCC1
Computed Properties
- Exact Mass: 183.19885
- Monoisotopic Mass: 183.198699802g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 104
- 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: 3.8
- Topological Polar Surface Area: 3.2?2
Experimental Properties
- PSA: 3.24
1H-Azepine, 1-hexylhexahydro- Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Hui Liu,Deyong Su,Guolin Cheng,Jimin Xu,Xinyan Wang,Yuefei Hu Org. Biomol. Chem., 2010,8, 1899-1904
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
20422-02-0 (1H-Azepine, 1-hexylhexahydro-) Related Products
- 1116-76-3(Trioctylamine)
- 1120-24-7(N,N-dimethyldecylamine)
- 4088-22-6(N-Methyldioctadecylamine)
- 7378-99-6(dimethyl(octyl)amine)
- 112-75-4(N,N-Dimethyltetradecylamine)
- 124-28-7(N,N-Dimethyloctadecan-1-amine)
- 4455-26-9(Methyldioctylamine)
- 10108-86-8(N,N,N-Trimethyloctan-1-aminium chloride)
- 112-69-6(N,N-Dimethylhexadecylamine)
- 626-67-5(1-METHYLPIPERIDINE)
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