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Cas Database

Name	NITROTRIAZOLONE	EINECS	N/A
CAS No.	932-64-9	Density	2.46g/cm³
PSA	107.36000	LogP	-0.47060
Solubility	17.2g/L at 25℃	Melting Point	N/A
Formula	C2H2 N4 O3	Boiling Point	°Cat760mmHg
Molecular Weight	130.063	Flash Point	°C
Transport Information	N/A	Appearance	N/A
Safety	Low toxicity by ingestion and skin contact. A skin and eye irritant. An unstable explosive. When heated to decomposition it emits toxic vapors of NO_x.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	D2-1,2,4-Triazolin-5-one, 3-nitro-(7CI,8CI); 3-Nitro-1,2,4-triazol-5-one;5-Nitro-2,4-dihydro-1,2,4-triazol-3-one; 5-Oxo-3-nitro-1,2,4-triazole; NSC119860; NTO; NTO (explosive)	Article Data	8

NITROTRIAZOLONE Synthetic route

: 930-33-6
2,4-dihydro-1,2,4-triazol-3-one

: 932-64-9
3-nitro-1,2,4-triazol-5-one

Conditions

Conditions	Yield
With sulfuric acid; nitric acid In water at 65℃; for 2h;	96%
With nitric acid at 50 - 85℃; for 0.5h;	84%
With nitric acid at 54.9 - 59.9℃;
With sulfuric acid; nitric acid
With sulfuric acid; nitric acid In water at 65℃; for 2h;

: 1-nitro-4,5-dihydro-1H-1,2,4-triazol-5-one

: 932-64-9
3-nitro-1,2,4-triazol-5-one

Conditions

Conditions	Yield
With sulfuric acid

: 1423-60-5
methyl ethynyl ketone

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 603-35-0
triphenylphosphine

: 2-(5-nitro-2,4H-1,2,4-triazol-4-yl-2-ylid)-1-methyl-3-triphenylphosphoniopropanone

Conditions

Conditions	Yield
In dichloromethane at 20℃; for 5h;	98%

: 922-67-8
propynoic acid methyl ester

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 603-35-0
triphenylphosphine

: methyl 2-(5-nitro-2,4H-1,2,4-triazol-4-yl-2-ylid)-1-methyl-3-triphenylphosphoniopropionate

Conditions

Conditions	Yield
In dichloromethane at 20℃; for 5h;	98%

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 603-35-0
triphenylphosphine

: 623-47-2
propynoic acid ethyl ester

: ethyl 2-(5-nitro-2,4H-1,2,4-triazol-4-yl-2-ylid)-1-methyl-3-triphenylphosphoniopropionate

Conditions

Conditions	Yield
In dichloromethane at 20℃; for 5h;	95%

: 5-amino-3-(3,4-diamino-1,2,4-triazol-5-yl)-1H-1,2,4-triazole

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: C4H7N9*C2H2N4O3

Conditions

Conditions	Yield
In water for 0.5h; Reflux;	90%

: 400063-96-9
3,6-diamino-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 3,6-diamino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-2-ium 3-nitro-5-oxo-1,2,4-triazolate

Conditions

Conditions	Yield
In water at 50℃; for 4h;	89%

: 996-98-5
oxalic acid hydrazide

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: C2H2N4O3*C2H6N4O2

Conditions

Conditions	Yield
In water at 80℃; for 2h;	88%

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 1003-34-5
3-chloro-1,2,4-triazol-5(1H,4H)-one

Conditions

Conditions	Yield
With hydrogenchloride for 7h; Substitution; Heating;	85.7%

: 50-00-0
formaldehyd

: 932-64-9
3-nitro-1,2,4-triazol-5-one

: 78663-78-2
2-Hydroxymethyl-5-nitro-2,4-dihydro-[1,2,4]triazol-3-one

Conditions

Conditions	Yield
In water; acetone for 8h; Ambient temperature;	85%

NITROTRIAZOLONE Chemical Properties

MF OF NITROTRIAZOLONE: C₂H₂N₄O₃

MW OF NITROTRIAZOLONE: 130.06228

NITROTRIAZOLONE Toxicity Data With Reference

1.	skn-rbt 500 mg/24H MLD	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. DE86-003296 .
2.	eye-rbt 100 mg MLD	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. DE86-003296 .
3.	orl-rat LD50:>5 g/kg	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. DE86-003296 .
4.	orl-mus LD50:>5 g/kg	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. DE86-003296 .

NITROTRIAZOLONE Safety Profile

RIDADR: 0490
HazardClass: 1.1D
Low toxicity by ingestion and skin contact. A skin and eye irritant. An unstable explosive. When heated to decomposition it emits toxic vapors of NO_x.

NITROTRIAZOLONE Standards and Recommendations

DOT Classification: Explosive 1.1D; Label: Explosive 1.1D

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