| Identification | |
| Name: | 1-Naphthalenecarboxylicacid, 5-bromo- |
| Synonyms: | 1-Naphthoicacid, 5-bromo- (6CI,7CI,8CI);5-Bromo-1-naphthalenecarboxylic acid;5-Bromo-1-naphthoic acid;5-Bromo-1-naphthylcarboxylic acid;1-naphthalenecarboxylic acid, 5-bromo-; |
| CAS: | 16726-67-3 |
| Molecular Formula: | C11H7BrO2 |
| Molecular Weight: | 0 |
| InChI: | InChI=1/C11H7BrO2/c12-10-6-2-3-7-8(10)4-1-5-9(7)11(13)14/h1-6H,(H,13,14) |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.648 g/cm3 |
| Refractive index: | 1.697 |
| Specification: |
The 5-Bromonaphthalene-1-carboxylic acid, with the CAS registry number 16726-67-3, is also called 5-bromo-1-naphthoic acid. It is a kind of organics, and should be stored at dry and cool environment. The molecular formula of the chemical is C11H7BrO2. The characteristics of this chemical are as followings: (1)ACD/LogP: 3.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 0.81; (5)ACD/BCF (pH 5.5): 5.24; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 30.49; (8)ACD/KOC (pH 7.4): 2.58; (9)#H bond acceptors: 2#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 26.3 Å2; (12)Index of Refraction: 1.697; (13)Molar Refractivity: 58.71 cm3; (14)Molar Volume: 152.2 cm3; (15)Polarizability: 23.27×10-24cm3; (16)Surface Tension: 59.9 dyne/cm; (17)Density: 1.648 g/cm3; (18)Flash Point: 208.5 °C; (19)Enthalpy of Vaporization: 71.18 kJ/mol; (20)Boiling Point: 421.2 °C at 760 mmHg; (21)Vapour Pressure: 7.58E-08 mmHg at 25°C. Addtionally, the following datas could be converted into the molecular structure: |
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