1,3,5-Triamino-2,4,6-trinitrobenzene supplier

Name
2,4,6-trinitrobenzene-1,3,5-triamine
EINECS
CAS No. 3058-38-6
Article Data33
CAS DataBase
Density 1.958g/cm³
Solubility
Melting Point 324 °C (decomp)
Formula C6H6 N6 O6
Boiling Point 669.5°Cat760mmHg
Molecular Weight 258.15
Flash Point 358.7°C
Transport Information
Appearance
Safety Low toxicity by ingestion and inhalation. A mild eye irritant. When heated to decomposition it emits toxic vapors of NO_x.
Risk Codes
Molecular Structure
Hazard Symbols Low toxicity by ingestion and inhalation. A mild eye irritant.
Synonyms 1,3,5-Triamino-2,4,6-trinitrobenzene;2,4,6-Trinitro-1,3,5-benzenetriamine; EDC 35; NSC 243156; TATB;s-Triaminotrinitrobenzene; sym-Triaminotrinitrobenzene
PSA 215.52000
LogP 3.47100

Synthetic route

: 489-98-5
picramide

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With 4-amino-1,2,4-triazole; sodium methylate In methanol at 25 - 60℃; for 21.5h; Product distribution / selectivity;	99.8%
Stage #1: picramide With 4-amino-1,2,4-triazole; sodium methylate In methanol; toluene at 25 - 60℃; for 16.5h; Stage #2: With acetic acid In methanol; toluene Product distribution / selectivity;	98%
With 4-amino-1,2,4-triazole; sodium methylate In dimethyl sulfoxide at 20℃; for 3h;	94.1%

: C30H27N9O12

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With hydrogenchloride In water; dimethyl sulfoxide at 80℃; for 6h; pH=1;	99.6%

: 68959-41-1
1,3,5-triethoxy-2,4,6-trinitrobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In toluene at 90℃; under 3863.02 Torr; for 4h; Product distribution / selectivity;	99.5%
With methanol; ammonia at -3 - 50℃; for 24h; Product distribution / selectivity; Sealed reactor; Industry scale;	89.5%

: C27H18Cl3N9O9

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With sodium hydroxide In water; dimethyl sulfoxide at 65℃; for 8h; pH=13.5;	99.5%

: C30H18F9N9O9

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With sodium hydroxide In water; dimethyl sulfoxide at 65℃; for 5h; pH=14;	99.4%

: C33H36N12O9

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With sodium hydroxide In water; dimethyl sulfoxide at 60℃; for 5h; pH=14;	99.4%

: C30H27N9O9

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With sodium hydroxide In water; dimethyl sulfoxide at 60℃; for 6h; pH=14;	99.2%

: 2631-68-7
1,3,5-trichloro-2,4,6-trinitrobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In toluene for 10h; Heating;	99%
With ammonia	90%
With ammonia In toluene for 24h; Reflux;	87%

: 21985-87-5
2,3,4,5,6-pentanitroaniline 1,2-dichloroethane

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In tetrachloromethane; toluene for 0.583333h;	97%
With ammonia

: 584-13-4
4-amino-1,2,4-triazole

: 489-98-5
picramide

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With sodium methylate In dimethyl sulfoxide at 20℃; for 3h;	89.5%

: 489-98-5
picramide

: 5470-11-1
hydroxylamine hydrochloride

A: 439614-66-1
1,3,5-triamino-2,4-dinitro-6-nitrososbenzene

B: 1630-08-6
1,3,5-trinitrobenzenediamine

C: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Stage #1: picramide; hydroxylamine hydrochloride With sodium methylate In methanol; dimethyl sulfoxide; toluene at 25 - 90℃; for 2.33333h; Stage #2: With acetic acid In dimethyl sulfoxide; toluene Product distribution / selectivity;	A n/a B n/a C 85%

...Expand

: 56140-58-0
1,3-diamino-5-hydroxytrinitrobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With diammonium phosphate In sulfolane at 20 - 177℃; for 8h;	80%

: 172265-85-9
2,4,6-trinitro-1,3,5-triacetylaminobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With hydrogenchloride In water at 100℃; for 0.5h; Temperature; Reagent/catalyst;	77.5%
With ammonia In water; N,N-dimethyl-formamide at 20 - 130℃; under 8791.75 Torr; for 0.666667 - 2.5h; Product distribution / selectivity;	68%
With ammonia In water at 123℃; for 1h;	58%

: 83430-12-0
1,3,5-tribromo-2,4,6-trinitrobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In toluene	72%

: Ac3TADNB

: 88106-06-3
N,N'-Diacetyl-2,4-diamino-1,3,5-trinitrobenzene

: 172265-85-9
2,4,6-trinitro-1,3,5-triacetylaminobenzene

A: 439614-66-1
1,3,5-triamino-2,4-dinitro-6-nitrososbenzene

B: 1630-08-6
1,3,5-trinitrobenzenediamine

C: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In water at 123℃; for 1h;	A n/a B n/a C 62%

...Expand

: 26243-62-9
N,N',N”-triacetyl-1,3,5-triaminobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Stage #1: N,N',N”-triacetyl-1,3,5-triaminobenzene With nitric acid; acetic anhydride at -5℃; for 8h; Stage #2: With nitric acid; acetic anhydride In water at 20 - 105℃; for 17h; Reagent/catalyst; Temperature; Solvent;	56%
Multi-step reaction with 2 steps 1: nitric acid; sulfuric acid / 0.25 h / -5 - 25 °C 2: hydrogenchloride / water / 0.5 h / 100 °C View Scheme
Multi-step reaction with 3 steps 1.1: nitric acid; sulfuric acid / 4 h / 50 °C / Cooling with ice 2.1: water / 6 h / 95 °C / Cooling with ice 3.1: acetic anhydride / 2 h / Cooling with ice 3.2: 8 h / 40 °C View Scheme

: 1423-11-6
1,3,5-trifluoro-2,4,6-trinitrobenzene

A: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

B: 73333-89-8
1-amino-3,5-difluorotrinitrobenzene

C: 78925-50-5
3,5-diamino-1-fluoro-2,4,6-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In dichloromethane at -73℃; for 1h; Yields of byproduct given;	A 0.22 g B n/a C n/a
With ammonia In dichloromethane at -73℃; for 1h; Yield given. Yields of byproduct given;

...Expand

: 1423-11-6
1,3,5-trifluoro-2,4,6-trinitrobenzene

A: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

B: 78925-50-5
3,5-diamino-1-fluoro-2,4,6-trinitrobenzene

Conditions

Conditions	Yield
With potassium hydrogencarbonate; tert-butylamine; trifluoroacetic acid 1.) CH2Cl2, -30 deg C, 2.) room temperature, 15h, 3.) 20 h; Yield given. Multistep reaction. Yields of byproduct given;

2.4.6-tribromo-1.3.5-triamino-benzene: 2.4.6-tribromo-1.3.5-triamino-benzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ethanol; ammonia in der Siedehitze;

: 2631-68-7
1,3,5-trichloro-2,4,6-trinitrobenzene

: 7664-41-7
ammonia

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 83430-12-0
1,3,5-tribromo-2,4,6-trinitrobenzene

: 7664-41-7
ammonia

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 21985-87-5
2,3,4,5,6-pentanitroaniline 1,2-dichloroethane

ammonia <10 percent >: ammonia <10 percent >

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 35572-78-2
2-amino-4,6-dinitrotoluene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: 80percent aq. H2SO4, 90percent aq. nitric acid / 24 h / Ambient temperature 2: 78 percent / 96percent aq. H2SO4, anisole / 0.5 h / Ambient temperature 3: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 4: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme

: 19406-51-0
4-Amino-2,6-dinitrotoluene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: 78 percent / 96percent H2SO4, 90percent HNO3 / acetic acid / 9 h / 0 °C 2: 35 percent / 96percent aq. H2SO4 / 60 h / 0 °C 3: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 4: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme
Multi-step reaction with 4 steps 1: 100 percent / 96percent aq. H2SO4, 90percent aq. HNO3 / 16 h / 0 - 5 °C 2: 78 percent / 96percent aq. H2SO4, anisole / 0.5 h / Ambient temperature 3: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 4: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme

: 84432-53-1
4-Amino-2,3,5,6-tetranitrotoluene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 2: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme

: 84432-52-0
4-amino-N,2,3,6-tetranitrotoluene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: 35 percent / 96percent aq. H2SO4 / 60 h / 0 °C 2: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 3: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme

: 84432-54-2
4-amino-N,2,3,5,6-pentanitrotoluene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: 78 percent / 96percent aq. H2SO4, anisole / 0.5 h / Ambient temperature 2: 40 percent / 90percent HNO3, 100percent H2SO4 / 1.) RT, 60 min, 2.) 75 deg C, 90 min 3: 97 percent / anh. ammonia / toluene; CCl4 / 0.58 h View Scheme

: 618-87-1
3, 5-dinitroaniline

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: sulfuric acid <100 percent >; nitric acid / 75 °C 2: ammonia View Scheme

: 18523-16-5
1,3,5-Trimethoxy-2,4,6-trinitrobenzene

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

Conditions

Conditions	Yield
With ammonia In diethyl ether
With ammonia In ethyl acetate under 760.051 Torr; for 6h;

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 4444-26-2
benzenehexamine

Conditions

Conditions	Yield
With ammonia; sodium In methanol Heating;	95%
With hydrogen; palladium on activated charcoal In ethyl acetate	80%
With phenylhydrazine 1.) 120 degC, 2.5 h; 2.) to 140 degC in 2.5 h; 3.) 140 degC, 1h;	68%

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: hexaamino-benzene trihydrochloride

Conditions

Conditions	Yield
Stage #1: 2,4,6-triamino-1,3,5-trinitrobenzene With palladium 10% on activated carbon; hydrogen In ethyl acetate under 3150.32 Torr; for 72h; Stage #2: With hydrogenchloride	93.2%
Stage #1: 2,4,6-triamino-1,3,5-trinitrobenzene With palladium 10% on activated carbon; hydrogen In ethyl acetate under 3150.32 Torr; for 72h; Stage #2: With hydrogenchloride; palladium 10% on activated carbon; hydrogen In water; ethyl acetate under 3150.32 Torr; for 5h;	92%
Stage #1: 2,4,6-triamino-1,3,5-trinitrobenzene With palladium 10% on activated carbon; hydrogen In ethyl acetate under 3150.32 Torr; for 72h; Stage #2: With hydrogenchloride; hydrogen In water; ethyl acetate for 5h;	92%
With hydrogenchloride; tin(II) chloride dihdyrate In ethyl acetate for 5h; Reflux;	75%

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 108-24-7
acetic anhydride

: 172265-85-9
2,4,6-trinitro-1,3,5-triacetylaminobenzene

Conditions

Conditions	Yield
sulfuric acid at 20 - 98℃; for 5h; Product distribution / selectivity;	93%
With sulfuric acid at 115 - 120℃; for 28h;	85.3%

: 67-56-1
methanol

: 3153-26-2
bis(acetylacetonate)oxovanadium

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 68-12-2, 33513-42-7
N,N-dimethyl-formamide

: [NH2Me2]4{[V6O6(OCH3)9(VO4)]4(1,3,5-triamido-2,4,6-trinitrobenzene)4}·(MeOH)24

Conditions

Conditions	Yield
at 160℃; for 48h; Autoclave;	80%

...Expand

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 135285-90-4
2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurzitane

: 3C6H6N12O12*C6H6N6O6

Conditions

Conditions	Yield
In water for 1.5h;	75.5%

: 67-56-1
methanol

: oxovanadium(IV) sulfate

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 68-12-2, 33513-42-7
N,N-dimethyl-formamide

: [NH2Me2]8{[V6O6(OCH3)9(SO4)]4(1,3,5-triamido-2,4,6-trinitrobenzene)4}·(MeOH)9

Conditions

Conditions	Yield
at 160℃; for 48h; Autoclave;	65%

...Expand

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: hexaaminobenzene tetrahydrochloride

Conditions

Conditions	Yield
With hydrogenchloride; tin(ll) chloride In water at 20℃; for 48h; Inert atmosphere; Schlenk technique;	64%

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 4328-17-0
trinitrophloroglucinol

Conditions

Conditions	Yield
With sodium hydroxide

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 608-97-9
benzenepentamine

Conditions

Conditions	Yield
With hydrogenchloride; tin

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

: 100-63-0
phenylhydrazine

: 4444-26-2
benzenehexamine

Conditions

Conditions	Yield
at 140 - 200℃;
at 140℃; dann bei 200grad;

: 4443-63-4
icosane-10,11-dione

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

A: 120829-14-3
5-Amino-6-nitro-2,3,8,9-tetranonylpyrazino<2,3-f>quinoxaline

B: 96355-62-3
2,3,6,7,10,11-hexanonyldipyrazino<2,3-f;2',3'-h>quinoxaline

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal 1.) ethyl acetate, 2.) ethanol, glacial acetic acid, H2O, 50 deg C, 1.5 h; Yield given. Multistep reaction. Yields of byproduct given;

...Expand

: 3058-38-6
2,4,6-triamino-1,3,5-trinitrobenzene

A: 4444-26-2
benzenehexamine

B: 120829-15-4
nitrobenzenepentamine

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal In ethyl acetate

1,3,5-Triamino-2,4,6-trinitrobenzene Chemical Properties

Empirical Formula of 1,3,5-Triamino-2,4,6-trinitrobenzene (CAS NO.3058-38-6): C₆H₆N₆O₆
Molecular Weight: 258.15 g/mol
EINECS: 221-297-5
Index of Refraction: 1.844
Density: 1.958 g/cm³
Flash Point: 358.7 °C
Enthalpy of Vaporization: 98.39 kJ/mol
Boiling Point: 669.5 °C at 760 mmHg
Vapour Pressure: 8.67E-18 mmHg at 25 °C
Structure of 1,3,5-Triamino-2,4,6-trinitrobenzene (CAS NO.3058-38-6):

IUPAC Name of 1,3,5-Triamino-2,4,6-trinitrobenzene (CAS NO.3058-38-6): 2,4,6-Trinitrobenzene-1,3,5-triamine

1,3,5-Triamino-2,4,6-trinitrobenzene Toxicity Data With Reference

1.	eye-rbt 100 mg MLD	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0537049 .
2.	orl-rat LD :>5 g/kg	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0537049 .
3.	ihl-rat LC :>212 mg/m3/1H	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0537049 .
4.	orl-mus LD :>5 g/kg	NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) UCRL-13701 .

1,3,5-Triamino-2,4,6-trinitrobenzene Consensus Reports

Reported in EPA TSCA Inventory.

1,3,5-Triamino-2,4,6-trinitrobenzene Safety Profile

Low toxicity by ingestion and inhalation. A mild eye irritant. When heated to decomposition it emits toxic vapors of NO_x.

1,3,5-Triamino-2,4,6-trinitrobenzene Specification

1,3,5-Triamino-2,4,6-trinitrobenzene ,its cas register number is 3058-38-6. It also can be called 1,3,5-Benzenetriamine, 2,4,6-trinitro- .

Product Name

2,4,6-trinitrobenzene-1,3,5-triamine

Synthetic route

1,3,5-Triamino-2,4,6-trinitrobenzene Chemical Properties

1,3,5-Triamino-2,4,6-trinitrobenzene Toxicity Data With Reference

1,3,5-Triamino-2,4,6-trinitrobenzene Consensus Reports

1,3,5-Triamino-2,4,6-trinitrobenzene Safety Profile

1,3,5-Triamino-2,4,6-trinitrobenzene Specification

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