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Basic Information
CAS No.: 932-53-6
Name: 6-AZATHYMINE
Article Data: 25
Molecular Structure:
Molecular Structure of 932-53-6 (6-AZATHYMINE)
Formula: C4H5 N3 O2
Molecular Weight: 127.103
Synonyms: as-Triazine-3,5(2H,4H)-dione,6-methyl- (6CI,8CI); 3,5-Dihydroxy-6-methyl-1,2,4-triazine;5-Methyl-6-azauracil; 6-Azathymine; 6-Methyl-1,2,4-triazine-3,5(2H,4H)-dione;6-Methyl-as-triazine-3,5-(2H,4H)-dione; NSC 3426; NSC 38620
Density: 1.67g/cm3
Melting Point: 210-212°C
Boiling Point: °Cat760mmHg
Flash Point: °C
Safety:
Safety Statements 22-24/25
RTECS XY8050000
PSA: 78.61000
LogP: -1.23340
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  • 6-methyl-2H-1,2,4-triazine-3,5-dione

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Chemistry

Molecular structure of 6-Azathymine (CAS NO.932-53-6) is:

Product Name: 6-Azathymine
CAS Registry Number: 932-53-6
IUPAC Name: 6-methyl-2H-1,2,4-triazine-3,5-dione
Molecular Weight: 127.1014 [g/mol]
Molecular Formula: C4H5N3O2
XLogP3: -0.3
H-Bond Donor: 2
H-Bond Acceptor: 3
Melting Point: 210-212°C
Index of Refraction: 1.691
Molar Refractivity: 29.1 cm3
Molar Volume: 75.9 cm3
Surface Tension: 66.5 dyne/cm
Density: 1.67 g/cm3
Other Registry Number: 16075-91-5 
Classification Code: Drug / Therapeutic Agent 

Toxicity Data With Reference

 

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   National Technical Information Service. Vol. AD277-689,
rat LD50 intraperitoneal 1800mg/kg (1800mg/kg) PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE) Archives Internationales de Pharmacodynamie et de Therapie. Vol. 95, Pg. 123, 1953.

Safety Profile

Safety Statements: 22-24/25 
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
RTECS XY8050000

Specification

 6-Azathymine , its cas register number is 932-53-6. It also can be called 3,5-Dihydroxy-6-methyl-1,2,4-triazine ; 5-Methyl-6-azauracil ; 6-Methyl-1,2,4-triazine-3,5(2H,4H)-dione ; 6-Methyl-1,2,4-triazine-3,5-dione ; 6-Methyl-as-triazine-3,5-(2H,4H)-dione ; 6-Methyl-as-triazine-3,5-diol ; AI3-50849 ; Azathymine ; CCRIS 3440 ; EINECS 213-253-9 ; NSC 3426 ; NSC 38620 ; USAF CB-28 ; 1,2,4-Triazine-3,5(2H,4H)-dione, 6-methyl- (9CI) ; 6-Methyl-1,2,4-triazine-3,5-diol ; as-Triazine-3,5(2H,4H)-dione, 6-methyl- .