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CAS No.: | 2509-18-4 |
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Name: | 4-(4-FORMYLPHENOXY)BENZOIC ACID |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C14H10O4 |
Molecular Weight: | 242.231 |
Synonyms: | 4-(4-Formylphenoxy)benzoic acid;Benzoicacid, p-(p-formylphenoxy)- (6CI,7CI,8CI); |
Density: | 1.315 g/cm3 |
Melting Point: | 170-173 °C(Solv: dichloromethane (75-09-2); ligroine (8032-32-4)) |
Boiling Point: | 429.565 °C at 760 mmHg |
Flash Point: | 166.637 °C |
PSA: | 63.60000 |
LogP: | 2.98960 |
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The Benzoic acid,4-(4-formylphenoxy)-, with the CAS registry number 2509-18-4, is also known as Benzoicacid, p-(p-formylphenoxy)- (6CI,7CI,8CI). This chemical's molecular formula is C14H10O4 and molecular weight is 242.23. What's more, its systematic name is 4-(4-Formylphenoxy)benzoic acid and it belongs to the product category of Benzene Derivatives.
Physical properties of Benzoic acid,4-(4-formylphenoxy)- are: (1)ACD/LogP: 3.13; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 4; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 44; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 63.6 Å2; (11)Index of Refraction: 1.64; (12)Molar Refractivity: 66.379 cm3; (13)Molar Volume: 184.216 cm3; (14)Polarizability: 26.315×10-24 cm3; (15)Surface Tension: 56.737 dyne/cm; (16)Density: 1.315 g/cm3; (17)Flash Point: 166.637 °C; (18)Enthalpy of Vaporization: 72.195 kJ/mol; (19)Boiling Point: 429.565 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c2ccc(Oc1ccc(C=O)cc1)cc2
(2)InChI: InChI=1/C14H10O4/c15-9-10-1-5-12(6-2-10)18-13-7-3-11(4-8-13)14(16)17/h1-9H,(H,16,17)
(3)InChIKey: OWRVVBLHUAFCNN-UHFFFAOYSA-N