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| CAS No.: | 134-85-0 |
|---|---|
| Name: | 4-Chlorobenzophenone |
| Molecular Structure: | |
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|
|
| Formula: | C13H9ClO |
| Molecular Weight: | 216.667 |
| Synonyms: | Benzophenone, 4-chloro- (8CI);para-Chlorobenzophenone;(4-chlorophenyl)-phenyl-methanone;Benzophenone, 4-chloro-;p-CBP;Methanone, (4-chlorophenyl)phenyl-;4-Chloro-benzophenone;Methanone; |
| EINECS: | 205-160-7 |
| Density: | 1.207 g/cm3 |
| Melting Point: | 93-96 °C(lit.) |
| Boiling Point: | 333 °C at 760 mmHg |
| Flash Point: | 176.1 °C |
| Solubility: | 20.706mg/L at 29℃ |
| Appearance: | white to off-white crystalline powder |
| Hazard Symbols: |
 C, Xi, Xn
|
| Risk Codes: | 34-36/37/38-20/21/22 |
| Safety: | 26-36/37/39-45-24/25-22 |
| Transport Information: | UN 3261 8/PG 2 |
| PSA: | 17.07000 |
| LogP: | 3.57100 |
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| Conditions | Yield |
|---|---|
| With butyltriphenylphosphonium chlorochromate In acetonitrile for 0.75h; Heating; | 100% |
| With diisopropyl-carbodiimide In toluene at 120℃; for 24h; Inert atmosphere; Sealed tube; | 100% |
| With Montmorillonite K10; ferric nitrate In hexane at 60℃; for 4h; | 99% |
| Conditions | Yield |
|---|---|
| With t-butyl bromide; dimethyl sulfoxide at 70 - 75℃; for 24h; | 100% |
| With trimethylsilyl iodide; dimethyl sulfoxide In tetrachloromethane at 75 - 80℃; for 6h; | 99% |
| With trichloroisocyanuric acid; silver nitrate In water; acetonitrile Ambient temperature; | 94% |
- 2998-98-3, 2998-99-4, 38032-14-3
4-cholorobenzophenone oxime
- 134-85-0
4-chlorobenzophenone
| Conditions | Yield |
|---|---|
| With tert.-butylhydroperoxide In tetrachloromethane for 2h; Product distribution; Heating; other oxidants, various solvents, various times, other temperature; | 100% |
| With tert.-butylhydroperoxide In tetrachloromethane for 4h; Heating; | 98% |
| With aluminum(III) nitrate nonahydrate; sodium bromide In dichloromethane at 20℃; for 1.75h; | 97% |
| Conditions | Yield |
|---|---|
| With potassium phosphate; 3,3-dimethyl-butan-2-one; C14H10Cl2N2O2Ru; tri tert-butylphosphoniumtetrafluoroborate In water; toluene at 100℃; for 24h; | 100% |
| With C35H26NO2PPd; caesium carbonate In toluene for 18h; Reagent/catalyst; Reflux; | 97% |
| With [Pd(2-((1-naphthalenyl)methylene)-N-phenylhydrazinecarbothioamide)Cl(PPh3)]; caesium carbonate In toluene at 110℃; for 12h; | 94% |
| Conditions | Yield |
|---|---|
| With pyridine; tert.-butylhydroperoxide; iodine In water at 80℃; chemoselective reaction; | 99% |
| With N-Bromosuccinimide; water In chloroform for 3h; Reflux; | 98% |
| With pyridine; tert.-butylhydroperoxide; air; K(1+)*AuCl4(1-)*0.5H2O=K[AuCl4]*0.5H2O In decane at 90℃; for 24h; | 96% |
| Conditions | Yield |
|---|---|
| With water; sodium carbonate; 3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate; palladium diacetate at 60℃; for 2h; Suzuki reaction; | 99% |
| With C35H35ClFeN3O2PPd; sodium hydrogencarbonate In water; toluene at 50℃; Inert atmosphere; | 99% |
| With C42H36ClFeN2O4PPdS*C6H15N; sodium carbonate In water; toluene at 50℃; for 1h; Suzuki-Miyaura Coupling; Inert atmosphere; Schlenk technique; Sealed tube; | 99% |
| Conditions | Yield |
|---|---|
| With palladium diacetate; N-picolinoylcyclohexylamine; potassium hydrogencarbonate In tert-Amyl alcohol at 150℃; for 24h; | 99% |
- 1679-18-1
4-Chlorophenylboronic acid
- 120622-90-4
N,N-bis(methanesulfonyl)benzamide
- 134-85-0
4-chlorobenzophenone
| Conditions | Yield |
|---|---|
| With bis-triphenylphosphine-palladium(II) chloride; potassium carbonate In toluene at 65℃; for 4h; Inert atmosphere; | 99% |
- 1441987-15-0
4-chloro-N,N-bis(methanesulfonyl)benzamide
- 98-80-6
phenylboronic acid
- 134-85-0
4-chlorobenzophenone
| Conditions | Yield |
|---|---|
| With bis-triphenylphosphine-palladium(II) chloride; potassium carbonate In toluene at 65℃; for 0.333333h; Catalytic behavior; Reagent/catalyst; Solvent; Temperature; Time; Inert atmosphere; | 99% |
- 637-87-6
1-Chloro-4-iodobenzene
- 201230-82-2
carbon monoxide
- 934-56-5
trimethyl(phenyl)stannane
- 134-85-0
4-chlorobenzophenone
| Conditions | Yield |
|---|---|
| bis(η3-allyl-μ-chloropalladium(II)) In N,N,N,N,N,N-hexamethylphosphoric triamide at 20℃; for 12h; | 98% |
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Specification
4-Chlorobenzophenone, its cas register number is 134-85-0. It also can be called 4-Chlorobenzophenone; AI3-00705;
Benzophenone, 4-chloro-; HSDB 2740; Methanone, (4-chlorophenyl)phenyl-; NSC 2872; p-CBP; para-Chlorobenzophenone. 4-Chlorobenzophenone is a white to off-white powder. It belongs to the Product Categories of Aromatic Benzophenones & Derivatives (substituted);Functional Materials; Photopolymerization Initiators; C13 to C14; Carbonyl Compounds; Ketones.
Physical properties about 4-Chlorobenzophenone are: (1)ACD/LogP: 4.33; (2)ACD/LogD (pH 5.5): 4.33; (3)ACD/LogD (pH 7.4): 4.33; (4)ACD/BCF (pH 5.5): 1150.74; (5)ACD/BCF (pH 7.4): 1150.74; (6)ACD/KOC (pH 5.5): 5403.14; (7)ACD/KOC (pH 7.4): 5403.14; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.594; (11)Molar Refractivity: 60.941 cm3; (12)Molar Volume: 179.499 cm3; (13)Polarizability: 24.159 10-24cm3; (14)Surface Tension: 44.181999206543 dyne/cm; (15)Density: 1.207 g/cm3; (16)Flash Point: 176.084 °C; (17)Enthalpy of Vaporization: 57.587 kJ/mol; (18)Boiling Point: 333.041 °C at 760 mmHg
When you are using this chemical, please be cautious about it as the following:
1. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice;
2. Wear suitable protective clothing, gloves and eye/face protection;
3. In case of accident or if you feel unwell, seek medical advice immediately (show label where possible);
4. Avoid contact with skin and eyes;
5.Do not breathe dust;
6. Wear suitable protective clothing;
You can still convert the following datas into molecular structure:
(1)InChI=1S/C13H9ClO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H;
(2)InChIKey=UGVRJVHOJNYEHR-UHFFFAOYSA-N;
(3)Smilesc1(C(c2ccccc2)=O)ccc(Cl)cc1