Cas no 682-03-1 (trihexylammonium nitrate)
trihexylammonium nitrate structure
Product Name:trihexylammonium nitrate
CAS No:682-03-1
MF:C24H52N2O3
MW:416.681287765503
CID:863125
PubChem ID:18705650
Update Time:2025-04-19
trihexylammonium nitrate Chemical and Physical Properties
Names and Identifiers
-
- trihexylammonium nitrate
- TETRAHEXYLAMMONIUM NITRATE
- tetrahexylazanium,nitrate
- 682-03-1
- SCHEMBL2953917
- N,N,N-Trihexylhexan-1-aminium nitrate
- DTXSID10595735
-
- Inchi： 1S/C24H52N.NO3/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;2-1(3)4/h5-24H2,1-4H3;/q+1;-1
- InChI Key： LHIGLAVLYYKORA-UHFFFAOYSA-N
- SMILES： [O-][N+](=O)[O-].[N+](CCCCCC)(CCCCCC)(CCCCCC)CCCCCC
Computed Properties
- Exact Mass: 332.3041
- Monoisotopic Mass: 416.39779352g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 29
- Rotatable Bond Count: 20
- Complexity: 214
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 62.9?2
Experimental Properties
- Melting Point: 62-65?°C
- PSA: 70.64
trihexylammonium nitrate Related Literature
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
682-03-1 (trihexylammonium nitrate) Related Products
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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