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213697-67-7
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Basic Information
CAS No.: 213697-67-7
Name: 2'-BROMO-N,N-DIMETHYL-[1,1'-BIPHENYL]-2-AMINE
Molecular Structure:
Molecular Structure of 213697-67-7 (2'-BROMO-N,N-DIMETHYL-[1,1'-BIPHENYL]-2-AMINE)
Formula: C14H14BrN
Molecular Weight: 276.17166
Synonyms: 2'-Bromo-N,N-dimethyl-1,1'-biphenyl-2-amine;2-(Dimethylamino)-2′-bromo-1,1′-biphenyl;2'-Bromo-N,N-dimethylbiphenyl-2-amine;
Density: 1.322 g/cm3
Melting Point: 58-64 °C
Boiling Point: 350.987 °C at 760 mmHg
Flash Point: 166.072 °C
Hazard Symbols: HarmfulXn,DangerousN
Risk Codes: 22-36-50/53
Safety: 26-36-60-61
Transport Information: UN 3082 9/PG 3
PSA: 3.24000
LogP: 4.18210
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Specification

This chemical is called [1,1'-Biphenyl]-2-amine,2'-bromo-N,N-dimethyl-, and it can also be named as 2'-Bromo-N,N-dimethyl-1,1'-biphenyl-2-amine. With the molecular formula of C14H14BrN, its molecular weight is 276.17166. The CAS registry number of this chemical is 213697-67-7, and its systematic name is 2'-Bromo-N,N-dimethylbiphenyl-2-amine. 

Other characteristics of the [1,1'-Biphenyl]-2-amine,2'-bromo-N,N-dimethyl- can be summarised as follows: (1)ACD/LogP: 3.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 1256; (6)ACD/BCF (pH 7.4): 1452; (7)ACD/KOC (pH 5.5): 5519; (8)ACD/KOC (pH 7.4): 6377; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.614; (14)Molar Refractivity: 72.848 cm3; (15)Molar Volume: 208.894 cm3; (16)Polarizability: 28.879×10-24 cm3; (17)Surface Tension: 42.433 dyne/cm; (18)Density: 1.322 g/cm3; (19)Flash Point: 166.072 °C; (20)Enthalpy of Vaporization: 59.565 kJ/mol; (21)Boiling Point: 350.987 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

When you are using this chemical, please be cautious about it as follows: This chemical is very toxic by inhalation and to aquatic organisms. It may cause long-term adverse effects in the aquatic environment. It's irritating to the eyes. You should wear suitable protective clothing when you use it. This material and its container must be disposed of as hazardous waste. Avoid releasing to the environment. Refer to special instructions safety data sheets. Additionally, in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Brc2ccccc2c1ccccc1N(C)C
2.InChI: InChI=1/C14H14BrN/c1-16(2)14-10-6-4-8-12(14)11-7-3-5-9-13(11)15/h3-10H,1-2H3
3.InChIKey: AILIDRDRRAFKFA-UHFFFAOYAN