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Basic Information
CAS No.: 16699-10-8
Name: 4-(4-N-METHYL-N-NITROSAMINOSTYRYL)QUINOLINE
Molecular Structure:
Molecular Structure of 16699-10-8 (4-(4-N-METHYL-N-NITROSAMINOSTYRYL)QUINOLINE)
Formula: C18H15 N3 O
Molecular Weight: 289.337
Synonyms: Quinoline,4-[p-(methylnitrosamino)styryl]- (8CI); NSC 101984
Density: 1.14g/cm3
Boiling Point: 525.1°Cat760mmHg
Flash Point: 271.4°C
Safety: Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.
PSA: 45.56000
LogP: 4.52280
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Chemistry

The Molecular Structure of 4-(4-N-Methyl-N-nitrosaminostyryl)quinoline (CAS NO.16699-10-8):

Molecular Formula: C18H15N3O
Molecular Weight: 289.331200 g/mol 
Index of Refraction: 1.616
Molar Refractivity: 88.58 cm3
Molar Volume: 253.4 cm3
Surface Tension: 45 dyne/cm
Density: 1.14 g/cm3
Flash Point: 271.4 °C
Enthalpy of Vaporization: 79.92 kJ/mol
Boiling Point: 525.1 °C at 760 mmHg
Vapour Pressure: 4.04E-11 mmHg at 25°C 
Classification Code: Tumor data
InChI
InChI=1/C18H15N3O/c1-21(20-22)16-10-7-14(8-11-16)6-9-15-12-13-19-18-5-3-2-4-17(15)18/h2-13H,1H3
Smiles
c12c(\C=C/c3ccc(N(N=O)C)cc3)ccnc1cccc2 
The IUPAC of 4-(4-N-Methyl-N-nitrosaminostyryl)quinoline (CAS NO.16699-10-8) is N-methyl-N-[4-(2-quinolin-4-ylethenyl)phenyl]nitrous amide .

Safety Profile

Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.

Specification

 4-(4-N-Methyl-N-nitrosaminostyryl)quinoline (CAS NO.16699-10-8) is also called as NSC 101984 ; 5-22-14-00729 (Beilstein Handbook Reference) ; BRN 0415860 ; N-Methyl-N-nitroso-4-(2-(4-quinolinyl)ethenyl)benzenamine ; NSC-101984 ; Quinoline, 4-(4-N-methyl-N-nitrosaminostyryl)- ; Quinoline, 4-(p-(methylnitrosamino)styryl)- ; Benzenamine, N-methyl-N-nitroso-4-(2-(4-quinolinyl)ethenyl)-(9CI) ; Quinoline, 4-(p-(methylnitrosamino)styryl)- (8CI) .