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599-69-9

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Basic Information
CAS No.: 599-69-9
Name: N,N-DIMETHYL-P-TOLUENESULFONAMIDE
Article Data: 58
Cas Database
Molecular Structure:
Molecular Structure of 599-69-9 (N,N-DIMETHYL-P-TOLUENESULFONAMIDE)
Formula: C9H13 N O2 S
Molecular Weight: 199.274
Synonyms: p-Toluenesulfonamide,N,N-dimethyl- (6CI,7CI,8CI); N,N,4-Trimethylbenzenesulfonamide;N,N-Dimethyl-4-toluenesulfonamide; N,N-Dimethyl-p-toluenesulfonamide;N,N-Dimethyltosylamide; NSC 2229
Density: 1.163g/cm3
Melting Point: 152-153 °C
Boiling Point: 298°Cat760mmHg
Flash Point: 134°C
Safety: Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and SOx.
PSA: 45.76000
LogP: 2.32610
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Chemistry

Molecular Formula: C9H13NO2S
Molar mass: 199.27 g/mol
EINECS: 209-971-7
Density: 1.163 g/cm3
Flash Point: 134 °C
Index of Refraction: 1.535
Boiling Point: 298 °C at 760 mmHg
Product categories of N,N-Dimethyl p-toluenesulfonamide (599-69-9): Piloty's acid
Structure of N,N-Dimethyl p-toluenesulfonamide (599-69-9):
 
XLogP3-AA: 2.9
H-Bond Donor: 0
H-Bond Acceptor: 3
IUPAC Name: N,N,4-Trimethylbenzenesulfonamide
Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)C
InChI: InChI=1S/C9H13NO2S/c1-8-4-6-9(7-5-8)13(11,12)10(2)3/h4-7H,1-3H3 
InChIKey: WZKOKGOAHBIPCI-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-rat LDLo:500 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 90 (1947),260.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and SOx.

Specification

 N,N-Dimethyl p-toluenesulfonamide (599-69-9) also can be called N1,N1,4-trimethylbenzene-1-sulfonamide ; 4,N,N-Trimethyl-benzenesulfonamide ; Benzenesulfonamide, N,N-dimethyl-4-methyl- (9CI) ; N,N,4-trimethylbenzenesulfonamide .