Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- supplier

Name
N-(4-chlorophenyl)-2-[(Z)-2H-pyrrol-2-ylidenemethyl]hydrazinecarbothioamide
EINECS
CAS No. 119033-84-0
Density 1.35g/cm³
Solubility
Melting Point
Formula C12H11 Cl N4 S
Boiling Point 396.4°Cat760mmHg
Molecular Weight 278.78
Flash Point 193.6°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

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Chemical Properties

The Molecular Structure of Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- (CAS NO.119033-84-0):

Molecular Formula: C₁₂H₁₁ClN₄S
Molecular Weight: 278.760540 g/mol
IUPAC: 1-(4-chlorophenyl)-3-[[(Z)-pyrrol-2-ylidenemethyl]amino]thiourea
Density: 1.35 g/cm³
Flash Point: 193.6 °C
Enthalpy of Vaporization: 64.67 kJ/mol
Boiling Point: 396.4 °C at 760 mmHg
Vapour Pressure: 1.71E-06 mmHg at 25°C }
Polar Surface Area: 54.17Å²
Index of Refraction: 1.67
Molar Refractivity: 76.89 cm³
Molar Volume: 205.6 cm³
Surface Tension: 49.2 dyne/cm
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 0.28
ACD/LogD (pH 7.4): 0.47
ACD/BCF (pH 5.5): 1
ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 4.15
ACD/KOC (pH 7.4): 6.45
InChI: InChI=1/C12H11ClN4S/c13-9-3-5-10(6-4-9)16-12(18)17-15-8-11-2-1-7-14-11/h1-8,14H,(H2,16,17,18)/b15-8+
Smiles: N(\N=C\c1[nH]ccc1)C(Nc1ccc(cc1)Cl)=S

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Toxicity Data With Reference

orl-mus LD50:201 µg/kg

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

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Safety Profile

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

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Specification

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- (CAS NO.119033-84-0) is also called as 1H-Pyrrole-2-carboxaldehyde, 4-(p-chlorophenyl)thiosemicarbazone ; Hydrazinecarbothioamide, N-(4-chlorophenyl)-2-(1H-pyrrol-2-ylmethylene)- (9CI) .

Product Name

N-(4-chlorophenyl)-2-[(Z)-2H-pyrrol-2-ylidenemethyl]hydrazinecarbothioamide

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Chemical Properties

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Toxicity Data With Reference

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Safety Profile

Semicarbazide, 4-(p-chlorophenyl)-1-(2-pyrrolylmethylene)-3-thio- Specification

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