Identification |
Name: | N,N-Dimethylaniline sulfate |
Synonyms: | 35462-54-5;Dwumetyloanilina [Polish];162744-63-0;Benzenamine, N,N-dimethyl-;NL 63-10P;NCI-C56428;N,N-Dimethylbenzenamine;N,N-(Dimethylamino)benzene;5882-44-0;N,N-Dimethylbenzeneamine;N,N-DIMETHYLANILINE;171745-67-8;Dimethylaniline, N,N-;Aniline, N,N-dimethyl-;Versneller NL 63/10;N,N-Dimethylaniline [UN2253] [Poison];N,N-Dimethylphenylamine;N,N-dimethylaniline; sulfuric acid;Benzenamine, N,N-dimethyl-, sulfate (1:1);168153-21-7; |
CAS: | 58888-49-6 |
Molecular Formula: | C8H11N.H2SO4 |
Molecular Weight: | 121.1796 |
InChI: | InChI=1/C8H11N.H2O4S/c1-9(2)8-6-4-3-5-7-8;1-5(2,3)4/h3-7H,1-2H3;(H2,1,2,3,4) |
Molecular Structure: |
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Properties |
Flash Point: | 62.8 ºC |
Boiling Point: | 193.5 ºC at 760 mmHg |
Density: | 0.95 g/cm3 |
Solubility: | Freely sol in alcohol, chloroform, ether Sol in acetone, benzene, org solvents Sol in oxygenated and chlorinated solvents Soluble in ethanol, ethyl ether, and acetone Water solubility of 1454 ppm at 25 deg C |
Specification: |
The N,N-Dimethylaniline sulfate with the cas number 58888-49-6, is also called N,N-Dimethylanilinium bisulfate. The systematic name is Benzenamine, N,N-dimethyl-, sulfate (1:1). Its related registry number is 121-69-7 (Parent). This chemical should be stored in dry and cool environment.
Properties Computed from Structure: (1)H-Bond Donor: 2; (2)H-Bond Acceptor: 5; (3)Rotatable Bond Count: 1; (4)Exact Mass: 219.056529; (5)MonoIsotopic Mass: 219.056529; (6)Topological Polar Surface Area: 86.2; (7)Heavy Atom Count: 14; (8)Formal Charge: 0; (9)Complexity: 154; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 0; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)SMILES: CN(C)c1ccccc1.S(O)(=O)(=O)O
(2)InChI: InChI=1/C8H11N.H2O4S/c1-9(2)8-6-4-3-5-7-8;1-5(2,3)4/h3-7H,1-2H3;(H2,1,2,3,4)
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Flash Point: | 62.8 ºC |
Color: | Pale-yellow, oily liquid [Note: A solid below 36 degrees F]. Yellowish to brownish, oily liquid |
Safety Data |
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