Products Categories
| CAS No.: | 112804-58-7 |
|---|---|
| Name: | 4'-FORMYL-BIPHENYL-2-CARBOXYLIC ACID |
| Article Data: | 1 |
| Molecular Structure: | |
|
|
|
| Formula: | C14H10O3 |
| Molecular Weight: | 226.232 |
| Synonyms: | AKOS BAR-0259;4-FORMYL-BIPHENYL-2-CARBOXYLIC ACID;4-FORMYL-BIPHENYL-2-CARBOXYLIC ACID;4-FORMYL[1,1-BIPHENYL]-2-CARBOXYLIC ACID;2-(4-Formylphenyl)benzoic acid;2-Biphenyl-4-forMyl-carboxylic acid |
| Density: | 1.264 g/cm3 |
| Melting Point: | 167 °C |
| Boiling Point: | 407.4 °C at 760 mmHg |
| Flash Point: | 214.4 °C |
| Hazard Symbols: |
 Xi
|
| PSA: | 54.37000 |
| LogP: | 2.86430 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 1219080-61-1IMIDAZOLE-2-BORONIC ACID
- Total:15 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The [1,1'-Biphenyl]-2-carboxylicacid, 4'-formyl-, with its CAS registry number 112804-58-7, has the systematic name of 4'-formylbiphenyl-2-carboxylic acid. And it has the molecular formula of C14H10O3 and molecular weight of 226.23. Besides, it is irritant which may cause inflammation to the skin or other mucous membranes.
The characteristics of [1,1'-Biphenyl]-2-carboxylicacid, 4'-formyl- are as follows: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.09; (4)ACD/LogD (pH 7.4): -0.19; (5)ACD/BCF (pH 5.5): 1.49; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.61; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 43.37 Å2; (13)Index of Refraction: 1.64; (14)Molar Refractivity: 64.52 cm3; (15)Molar Volume: 178.9 cm3; (16)Polarizability: 25.58×10-24cm3; (17)Surface Tension: 55.2 dyne/cm; (18)Density: 1.264 g/cm3; (19)Flash Point: 214.4 °C; (20)Enthalpy of Vaporization: 69.52 kJ/mol; (21)Boiling Point: 407.4 °C at 760 mmHg; (22)Vapour Pressure: 2.28E-07 mmHg at 25°C.
What's more, the following datas could be converted into the molecular structure:
(1)SMILES:O=Cc1ccc(cc1)c2ccccc2C(=O)O
(2)InChI:InChI=1/C14H10O3/c15-9-10-5-7-11(8-6-10)12-3-1-2-4-13(12)14(16)17/h1-9H,(H,16,17)
(3)InChIKey:VOHABWOWKDXZIM-UHFFFAOYAH
(4)Std. InChI:InChI=1S/C14H10O3/c15-9-10-5-7-11(8-6-10)12-3-1-2-4-13(12)14(16)17/h1-9H,(H,16,17)
(5)Std. InChIKey:VOHABWOWKDXZIM-UHFFFAOYSA-N