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CAS No.: | 14704-31-5 |
---|---|
Name: | 3-(Bromomethyl)biphenyl |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C13H11Br |
Molecular Weight: | 247.134 |
Synonyms: | Biphenyl,3-(bromomethyl)- (8CI);3-(Bromomethyl)biphenyl;3-Bromomethyl-1,1'-biphenyl;1,1'-Biphenyl,3-(bromomethyl)-;m-Phenylbenzyl bromide;3-Bromo methylphenylbenzene; |
Density: | 1.341 g/cm3 |
Melting Point: | 57-61 °C |
Boiling Point: | 328.6 °C at 760 mmHg |
Flash Point: | 158.1 °C |
Appearance: | off-white to light yellow crystal powder |
Hazard Symbols: | C, Xi, N |
Risk Codes: | 22-34-50/53-36/37/38 |
Safety: | 26-36/37/39-45-60-61-37/39 |
Transport Information: | UN 3261 8/PG 2 |
PSA: | 0.00000 |
LogP: | 4.24850 |
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The 3-Phenylbenzyl bromide, with the CAS registry number 14704-31-5, is also known as 3-Bromo methylphenylbenzene. It belongs to the product categories of Biphenyl & Diphenyl ether; API intermediates; Aromatics. This chemical's molecular formula is C13H11Br and molecular weight is 247.13. What's more, its systematic name is 3-(bromomethyl)biphenyl.
Physical properties of 3-Phenylbenzyl bromide are: (1)ACD/LogP: 4.68; (2)# of Rule of 5 Violations: 0; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.605; (5)Molar Refractivity: 63.49 cm3; (6)Molar Volume: 184.2 cm3; (7)Surface Tension: 42.2 dyne/cm; (8)Density: 1.341 g/cm3; (9)Flash Point: 158.1 °C; (10)Enthalpy of Vaporization: 54.84 kJ/mol; (11)Boiling Point: 328.6 °C at 760 mmHg; (12)Vapour Pressure: 0.000358 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. It can cause burns. It is irritating to eyes, respiratory system and skin. It is very toxic to aquatic organisms, and it may cause long-term adverse effects in the aquatic environment. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible). This material and its container must be disposed of as hazardous waste. It should be avoided releasing to the environment just refering to special instructions/safety data sheet.
You can still convert the following datas into molecular structure:
(1)SMILES: BrCc2cccc(c1ccccc1)c2
(2)InChI: InChI=1S/C13H11Br/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-9H,10H2
(3)InChIKey: RTFPTPXBTIUISM-UHFFFAOYSA-N