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3,3'-Diaminobenzophenone

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Name

3,3'-Diaminobenzophenone

EINECS 210-281-3
CAS No. 611-79-0 Density 1.233 g/cm3
PSA 69.11000 LogP 3.24440
Solubility Insoluble in water Melting Point 150-151 °C
Formula C13H12N2O Boiling Point 469.4 °C at 760 mmHg
Molecular Weight 212.251 Flash Point 237.7 °C
Transport Information N/A Appearance yellow acicular crystal
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 611-79-0 (3,3'-Diaminobenzophenone) Hazard Symbols N/A
Synonyms

Benzophenone,3,3'-diamino- (6CI,7CI,8CI);3,3'-Diaminobenzophenone;NSC 113058;m,m'-Diaminobenzophenone;bis(3-aminophenyl)methanone;3,3'-Diaminobenzophenone;Bis(3-aminophenyl)methanon;Bis(3-aminophenyl)methanone;Methanone, bis(3-aminophenyl)-;

Article Data 18

3,3'-Diaminobenzophenone Synthetic route

21222-05-9

3,3'-dinitrobenzophenone

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With tetrabutylammomium bromide; tin(ll) chloride at 90℃; for 0.416667h;91%
With tin(ll) chloride In ethanol at 70℃; for 0.5h;89%
With hydrogenchloride; acetic acid; tin(ll) chloride

C16H18N2S2

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With ammonium persulfate; Montmorillonite K-10 clay for 0.0666667h; microwave irradiation;87%
119-61-9

benzophenone

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
Stage #1: benzophenone With dinitrogen pentoxide In dichloromethane at 30℃; for 5h; Molecular sieve;
Stage #2: With hydrogen; nickel In dichloromethane under 11251.1 Torr; for 5h; Temperature; Pressure;
83%
Multi-step reaction with 2 steps
1: nitric acid
2: tin; hydrochloric acid
View Scheme
Multi-step reaction with 2 steps
1: nitric acid
2: tin; hydrochloric acid
View Scheme
Multi-step reaction with 2 steps
1: sulfuric acid; nitric acid / 2 h / 60 °C
2: hydrogenchloride; water; tin(ll) chloride / ethyl acetate / 4 h / Reflux
View Scheme
Multi-step reaction with 2 steps
1: sulfuric acid; nitric acid / 1 h / 75 °C
2: iron; ammonium chloride / ethanol; water / 4 h / 80 °C / Inert atmosphere
View Scheme
619-25-0

3-Nitrobenzyl alcohol

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: concentrated sulfuric acid / 130 - 140 °C / Reinigung durch Behandeln mit Aceton
2: glacial acetic acid; water; chromic acid
3: tin dichloride; hydrochloric acid; glacial acetic acid
View Scheme
Multi-step reaction with 3 steps
1: sulfuric acid / 135 °C
2: glacial acetic acid; water; chromic acid
3: tin dichloride; hydrochloric acid
View Scheme
4164-43-6

bis(3-nitrophenyl)methane

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: glacial acetic acid; water; chromic acid
2: tin dichloride; hydrochloric acid; glacial acetic acid
View Scheme
Multi-step reaction with 2 steps
1: glacial acetic acid; water; chromic acid
2: tin dichloride; hydrochloric acid
View Scheme
98-95-3

nitrobenzene

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: concentrated sulfuric acid / 130 - 140 °C / Reinigung durch Behandeln mit Aceton
2: glacial acetic acid; water; chromic acid
3: tin dichloride; hydrochloric acid; glacial acetic acid
View Scheme
Multi-step reaction with 3 steps
1: sulfuric acid / 135 °C
2: glacial acetic acid; water; chromic acid
3: tin dichloride; hydrochloric acid
View Scheme

2-chloro-4'-bromo-5,3'-dinitro benzophenone

5137-55-3

Aliquat 336

A

119-61-9

benzophenone

B

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With sodium hydroxide; hydrogen; magnesium sulfate; palladium In benzene

dinitro-dichloro benzophenone

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With hydrogen; palladium In benzene
7498-65-9

4,4'-dichloro-3,3'-dinitrobenzophenone

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With sodium hydroxide; hydrogen; palladium/active carbon In 1,4-dioxane
83704-08-9

3,3'-dinitro-4-bromo benzophenone

611-79-0

3,3'-diaminobenzophenone

Conditions
ConditionsYield
With hydrogen; palladium/active carbon In 1,4-dioxane

3,3'-Diaminobenzophenone Specification

The 3,3'-Diaminobenzophenone, with the CAS registry number 611-79-0 and EINECS registry number 210-281-3, has the systematic name of bis(3-aminophenyl)methanone. And the molecular formula of this chemical is C13H12N2O. It belongs to the following product categories: Benzophenones (for High-Performance Polymer Research); Functional Materials; Reagent for High-Performance Polymer Research.

The physical properties of 3,3'-Diaminobenzophenone are as following: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.91; (4)ACD/LogD (pH 7.4): 1.92; (5)ACD/BCF (pH 5.5): 16.63; (6)ACD/BCF (pH 7.4): 16.83; (7)ACD/KOC (pH 5.5): 259.41; (8)ACD/KOC (pH 7.4): 262.55; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 23.55 Å2; (13)Index of Refraction: 1.673; (14)Molar Refractivity: 64.51 cm3; (15)Molar Volume: 172.1 cm3; (16)Polarizability: 25.57×10-24cm3; (17)Surface Tension: 59.7 dyne/cm; (18)Density: 1.233 g/cm3; (19)Flash Point: 237.7 °C; (20)Enthalpy of Vaporization: 73.18 kJ/mol; (21)Boiling Point: 469.4 °C at 760 mmHg; (22)Vapour Pressure: 5.51E-09 mmHg at 25°C.

Preparation of 3,3'-Diaminobenzophenone: It can be prepared by 3,3'-dinitro-benzophenone. The reaction will need reagent alcoholic ammonium sulfide.

3,3'-Diaminobenzophenone can be prepared by 3,3'-dinitro-benzophenone

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(N)ccc1)c2cccc(N)c2
(2)InChI: InChI=1/C13H12N2O/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8H,14-15H2
(3)InChIKey: TUQQUUXMCKXGDI-UHFFFAOYAF

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