Cas no 6622-64-6 (Trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium;chloride)
6622-64-6 structure
Product Name:Trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium;chloride
CAS No:6622-64-6
MF:C8H14ClN3S
MW:219.734858989716
CID:1711947
PubChem ID:12684330
Update Time:2025-04-21
Trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium;chloride Chemical and Physical Properties
Names and Identifiers
-
- NSC54658
- Trimethyl-4-(2-methylthiopyrimidinyl)ammoniumchlorid
- trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium,chloride
- chloride
- trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium
- N,N,N-Trimethyl-2-(methylsulfanyl)pyrimidin-4-aminium chloride
- 6622-64-6
- NSC-54658
- DTXSID40506819
- Trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium;chloride
-
- Inchi: 1S/C8H14N3S.ClH/c1-11(2,3)7-5-6-9-8(10-7)12-4;/h5-6H,1-4H3;1H/q+1;/p-1
- InChI Key: NBKXLPICVJTYST-UHFFFAOYSA-M
- SMILES: [Cl-].S(C)C1=NC=CC(=N1)[N+](C)(C)C
Computed Properties
- Exact Mass: 184.09102
- Monoisotopic Mass: 219.0596963g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 144
- 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: 51.1?2
Experimental Properties
- PSA: 25.78
- LogP: -1.60080
Trimethyl-(2-methylsulfanylpyrimidin-4-yl)azanium;chloride Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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