1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone supplier

Name
(2E)-N-(4-chlorophenyl)-2-[(1-methyl-1H-pyrrol-2-yl)methylidene]hydrazinecarbothioamide
EINECS
CAS No. 119033-85-1
Density 1.29g/cm³
Solubility
Melting Point
Formula C13H13 Cl N4 S
Boiling Point 431.04°C at 760 mmHg
Molecular Weight 292.81
Flash Point 214.486°C
Transport Information
Appearance
Safety A poison by ingestion. When heated to decomposition it emits toxic vapors of NO_x, SO_x, and Cl⁻.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms
PSA
LogP

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Chemical Properties

The Molecular Structure of 1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone (CAS NO.119033-85-1):

Molecular Formula: C₁₃H₁₃ClN₄S
Molecular Weight: 292.787120 g/mol
IUPAC: 1-(4-chlorophenyl)-3-[(E)-(1-methylpyrrol-2-yl)methylideneamino]thiourea
Density: 1.29 g/cm³
Flash Point: 214.486 °C
Enthalpy of Vaporization: 68.66 kJ/mol
Boiling Point: 431.04 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
Polar Surface Area: 73.44 Å²
Index of Refraction: 1.644
Molar Refractivity: 82.219 cm³
Molar Volume: 226.96 cm³
Surface Tension: 45.736 dyne/cm
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 5
ACD/LogD (pH 7.4): 5
ACD/BCF (pH 5.5): 1912
ACD/BCF (pH 7.4): 1909
ACD/KOC (pH 5.5): 7770
ACD/KOC (pH 7.4): 7758
InChI: InChI=1/C13H13ClN4S/c1-18-8-2-3-12(18)9-15-17-13(19)16-11-6-4-10(14)5-7-11/h2-9H,1H3,(H2,16,17,19)/b15-9+
Smiles: N(\N=C\c1n(ccc1)C)C(Nc1ccc(cc1)Cl)=S

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Toxicity Data With Reference

orl-mus LD50:7519 µg/kg

YHHPAL Yaoxue Xuebao. Acta Pharmaceutica Sinica. Pharmaceutical Journal. 24 (1989),822.

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Safety Profile

A poison by ingestion. When heated to decomposition it emits toxic vapors of NO_x, SO_x, and Cl⁻.

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Specification

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone (CAS NO.119033-85-1) is also called as Semicarbazide, 4-(p-chlorophenyl)-1-((1-methyl-2-pyrrolyl)methylene)-3-thio- ; Hydrazinecarbothioamide, N-(4-chlorophenyl)-2-((1-methyl-1H-pyrrol-2-yl)methylene)- (9CI) .

Product Name

(2E)-N-(4-chlorophenyl)-2-[(1-methyl-1H-pyrrol-2-yl)methylidene]hydrazinecarbothioamide

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Chemical Properties

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Toxicity Data With Reference

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Safety Profile

1H-Pyrrole-2-carboxaldehyde, 1-methyl-, 4-(p-chlorophenyl)thiosemicarbazone Specification

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