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58888-49-6

Basic Information
CAS No.: 58888-49-6
Name: N,N-dimethylaniline
Molecular Structure:
Molecular Structure of 58888-49-6 (N,N-dimethylaniline)
Formula: C8H11N.H2SO4
Molecular Weight: 219.262
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;
Density: 0.95 g/cm3
Melting Point: 88-89 oC
Boiling Point: 193.5 oC at 760 mmHg
Flash Point: 62.8 oC
PSA: 3.24000
LogP: 1.75260
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    Molecular Formula C8H11N.H2SO4 Molecular Weight 219.25 CAS Registry Number 58888-49-6 NameN,N-Dimethylaniline sulfateSynon…

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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)