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1200-00-6

Basic Information
CAS No.: 1200-00-6
Name: isonicotinaldehyde thiosemicarbazone
Article Data: 42
Molecular Structure:
Molecular Structure of 1200-00-6 (isonicotinaldehyde thiosemicarbazone)
Formula: C7H8 N4 S
Molecular Weight: 180.233
Synonyms: Isonicotinaldehyde,thiosemicarbazone (6CI,7CI,8CI); 4-Formylpyridine thiosemicarbazone;4-Pyridinecarboxaldehyde thiosemicarbazone; 4-Pyridylcarboxaldehydethiosemicarbazone; G 527; NSC 731
Density: 1.32g/cm3
Boiling Point: 346.5°C at 760 mmHg
Flash Point: 163.3°C
Safety: Poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx. See also ALDEHYDES.
PSA: 95.39000
LogP: 1.33990
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Chemistry

Product Name: Isonicotinaldehyde thiosemicarbazone
CAS Registry Number: 1200-00-6
IUPAC Name: [(Z)-pyridin-4-ylmethylideneamino]thiourea
Molecular Weight: 180.23022 [g/mol]
Molecular Formula: C7H8N4S
XLogP3-AA: 0.1
H-Bond Donor: 2
H-Bond Acceptor: 2
Surface Tension: 51.4 dyne/cm
Density: 1.32 g/cm3
Flash Point: 163.3 °C
Enthalpy of Vaporization: 59.06 kJ/mol
Boiling Point: 346.5 °C at 760 mmHg
Vapour Pressure: 5.74E-05 mmHg at 25°C 
Classification Code: Drug / Therapeutic Agent
Following is the molecular structure of Isonicotinaldehyde thiosemicarbazone (CAS NO.1200-00-6) is:

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   National Technical Information Service. Vol. AD691-490,
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01772,
mouse LD50 oral 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 676, 1965.

Safety Profile

Poison by ingestion, intraperitoneal, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx. See also ALDEHYDES.

Specification

 Isonicotinaldehyde thiosemicarbazone , its cas register number is 1200-00-6. It also can be called 4-Formylpyridine thiosemicarbazone ; 4-Pyridylcarboxaldehyde thiosemicarbazone ; 5-21-07-00360 (Beilstein Handbook Reference) ; 
AI3-52028 ; BRN 0132697 ; EINECS 214-848-6 ; G 527 ; NSC 731 ; Pyridine-4-carboxaldehyde thiosemicarbazone ; Hydrazinecarbothioamide, 2-(4-pyridinylmethylene)- .