Cas no 23297-50-9 (tetrakis(3-methylbutyl)azanium thiocyanate)
23297-50-9 structure
Product Name:tetrakis(3-methylbutyl)azanium thiocyanate
CAS No:23297-50-9
MF:C21H44N2S
MW:356.652464866638
CID:278397
PubChem ID:3015154
Update Time:2025-04-19
tetrakis(3-methylbutyl)azanium thiocyanate Chemical and Physical Properties
Names and Identifiers
-
- tetrakis(3-methylbutyl)azanium thiocyanate
- AC1MI0PE
- AG-E-67852
- CTK1A5894
- EINECS 245-565-6
- Tetraisoamylammonium thiocyanate
- Tetraisopentylammonium thiocyanate
- tetraisopentyl-ammonium, thiocyanate
- WAD2LPS9YU
- SCHEMBL1289739
- NS00051352
- tetraisopentyl-ammonium thiocyanate
- 23297-50-9
- 1-Butanaminium, 3-methyl-N,N,N-tris(3-methylbutyl)-, thiocyanate
- DTXSID80177865
-
- Inchi： 1S/C20H44N.CHNS/c1-17(2)9-13-21(14-10-18(3)4,15-11-19(5)6)16-12-20(7)8;2-1-3/h17-20H,9-16H2,1-8H3;3H/q+1;/p-1
- InChI Key： DWCVOTSGWLRENH-UHFFFAOYSA-M
- SMILES： [S-]C#N.[N+](CCC(C)C)(CCC(C)C)(CCC(C)C)CCC(C)C
Computed Properties
- Exact Mass: 356.32282
- Monoisotopic Mass: 356.32252
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 12
- Complexity: 218
- 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: 24.8
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 23.79
tetrakis(3-methylbutyl)azanium thiocyanate Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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