Products Categories
| CAS No.: | 5731-13-5 |
|---|---|
| Name: | 4-(4-ETHYLPHENYL)BENZOIC ACID |
| Article Data: | 12 |
| Molecular Structure: | |
|
|
|
| Formula: | C15H14O2 |
| Molecular Weight: | 226.275 |
| Synonyms: | 4-Biphenylcarboxylicacid, 4'-ethyl- (7CI,8CI);4-(4-Ethylphenyl)benzoic acid;4-Ethylbiphenyl-4'-carboxylic acid;4'-Ethyl-1,1'-biphenyl-4-carboxylic acid;4'-Ethyl-4-biphenylcarboxylic acid; |
| Density: | 1.13g/cm3 |
| Melting Point: | 221°C |
| Boiling Point: | 389.8 °C at 760 mmHg |
| Flash Point: | 180.5 °C |
| Appearance: | white to cream solid |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 24/25-36-26 |
| PSA: | 37.30000 |
| LogP: | 3.61420 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
What can I do for you?
Get Best Price
Specification
The 4'-Ethyl-4-biphenylcarboxylic acid with the CAS number 5731-13-5 is also called [1,1'-Biphenyl]-4-carboxylicacid, 4'-ethyl-. The systematic name is 4'-ethylbiphenyl-4-carboxylic acid. Its molecular formula is C15H14O2. This chemical belongs to the following product categories: (1)Biphenyl derivatives; (2)Biphenyl & Diphenyl ether.
The properties of the 4'-Ethyl-4-biphenylcarboxylic acid are: (1)ACD/LogP: 4.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.45; (4)ACD/LogD (pH 7.4): 1.88; (5)ACD/BCF (pH 5.5): 120.1; (6)ACD/BCF (pH 7.4): 3.24; (7)ACD/KOC (pH 5.5): 459.6; (8)ACD/KOC (pH 7.4): 12.4; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3Å2; (13)Index of Refraction: 1.587; (14)Molar Refractivity: 67.32 cm3; (15)Molar Volume: 200 cm3; (16)Polarizability: 26.68×10-24cm3; (17)Surface Tension: 45.4 dyne/cm; (18)Enthalpy of Vaporization: 67.41 kJ/mol; (19)Vapour Pressure: 8.98×10-7 mmHg at 25°C.
Preparation: This chemical can be prepared by 1-[4'-(5-phenyl-[1,3,4]oxadiazol-2-yl)-biphenyl-4-yl]-ethanone. This reaction needs reagent HI, red phosphorus and solvent acetic acid at heating condition. The reaction time is 15 hours. The yield is90%.
Uses: This chemical can react with methanol to prepare 4'-ethyl-biphenyl-4-carboxylic acid methyl ester. This reaction needs reagent conc. H2SO4 at heating condition. The yield is 89%.
.jpg)
While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then you should avoid this chemical contact with skin and eyes. Finally in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c2ccc(c1ccc(cc1)CC)cc2
(2)InChI: InChI=1/C15H14O2/c1-2-11-3-5-12(6-4-11)13-7-9-14(10-8-13)15(16)17/h3-10H,2H2,1H3,(H,16,17)
(3)InChIKey: SCEBDBNGUCNRCE-UHFFFAOYAB