3'-Methoxy-biphenyl-3-ylamine supplier

Name
3'-Methoxy-biphenyl-3-ylamine
EINECS
CAS No. 400748-70-1
Article Data11
CAS DataBase
Density 1.1 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₃NO
Boiling Point 370.2 °C at 760 mmHg
Molecular Weight 199.25
Flash Point 190.6 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 41
Molecular Structure
Hazard Symbols Xi
Synonyms TIMTEC-BB SBB007485;CHEMBRDG-BB 4005743;AKOS BAR-0119;3'-METHOXY[1,1'-BIPHENYL]-3-AMINE;
PSA 35.25000
LogP 3.52560

3'-Methoxy-biphenyl-3-ylamine Specification

The 3'-Methoxy-biphenyl-3-ylamine is an organic compound with the formula C₁₃H₁₃NO. The systematic name of this chemical is 3'-methoxybiphenyl-3-amine. With the CAS registry number 400748-70-1, it is also named as [1,1'-Biphenyl]-3-amine, 3'-methoxy-.

Physical properties about 3'-Methoxy-biphenyl-3-ylamine are: (1)ACD/LogP: 2.18; (2)ACD/LogD (pH 5.5): 2.15; (3)ACD/LogD (pH 7.4): 2.18; (4)ACD/BCF (pH 5.5): 25.17; (5)ACD/BCF (pH 7.4): 26.75; (6)ACD/KOC (pH 5.5): 344.11; (7)ACD/KOC (pH 7.4): 365.72; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 12.47 Å²; (12)Index of Refraction: 1.598; (13)Molar Refractivity: 61.75 cm³; (14)Molar Volume: 181 cm³; (15)Polarizability: 24.48×10^-24cm³; (16)Surface Tension: 42.8 dyne/cm; (17)Density: 1.1 g/cm³; (18)Flash Point: 190.6 °C; (19)Enthalpy of Vaporization: 61.71 kJ/mol; (20)Boiling Point: 370.2 °C at 760 mmHg; (21)Vapour Pressure: 1.12E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c2cc(c1cccc(N)c1)ccc2)C
(2)InChI: InChI=1/C13H13NO/c1-15-13-7-3-5-11(9-13)10-4-2-6-12(14)8-10/h2-9H,14H2,1H3
(3)InChIKey: FTMWHDFYWZAJNW-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C13H13NO/c1-15-13-7-3-5-11(9-13)10-4-2-6-12(14)8-10/h2-9H,14H2,1H3
(5)Std. InChIKey: FTMWHDFYWZAJNW-UHFFFAOYSA-N

Product Name

3'-Methoxy-biphenyl-3-ylamine

3'-Methoxy-biphenyl-3-ylamine Specification

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