3-Methoxy-4-phenylaniline supplier

Name
2-METHOXY-[1,1'-BIPHENYL]-4-AMINE
EINECS 1312995-182-4
CAS No. 56970-24-2
Article Data5
CAS DataBase
Density 1.1g/cm³
Solubility
Melting Point
Formula C₁₃H₁₃NO
Boiling Point 316.4 °C at 760 mmHg
Molecular Weight 199.252
Flash Point 146.9 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 41
Molecular Structure
Hazard Symbols
Synonyms 2-Methoxybiphenyl-4-ylamine;2-Phenyl-5-aminoanisole;3-Methoxy-4-biphenylamine;3-Methoxy-4-phenylaniline;
PSA 35.25000
LogP 3.52560

3-Methoxy-4-phenylaniline Specification

The CAS register number of 3-Methoxy-4-phenylaniline is 56970-24-2. It also can be called as 2-Methoxy-[1,1'-biphenyl]-4-amine and the IUPAC name about this chemical is 2-methoxy-4-phenylaniline. The molecular formula about this chemical is C₁₃H₁₃NO and the molecular weight is 199.25. Classification code about this chemical is Tumor data.

Physical properties about 3-Methoxy-4-phenylaniline are: (1)ACD/LogP: 2.42; (2)ACD/LogD (pH 5.5): 2.41; (3)ACD/LogD (pH 7.4): 2.42; (4)ACD/BCF (pH 5.5): 39.63; (5)ACD/BCF (pH 7.4): 40.48; (6)ACD/KOC (pH 5.5): 481.76; (7)ACD/KOC (pH 7.4): 492.09; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 12.47Å²; (12)Index of Refraction: 1.598; (13)Molar Refractivity: 61.75 cm³; (14)Molar Volume: 181 cm³; (15)Polarizability: 24.48x10^-24cm³; (16)Surface Tension: 42.8 dyne/cm; (17)Enthalpy of Vaporization: 55.78 kJ/mol; (18)Boiling Point: 316.4 °C at 760 mmHg; (19)Vapour Pressure: 0.000411 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c2cc(ccc2c1ccccc1)N)C
(2)InChI: InChI=1/C13H13NO/c1-15-13-9-11(14)7-8-12(13)10-5-3-2-4-6-10/h2-9H,14H2,1H3
(3)InChIKey: HARIVKURFQYWBH-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C13H13NO/c1-15-13-9-11(14)7-8-12(13)10-5-3-2-4-6-10/h2-9H,14H2,1H3
(5)Std. InChIKey: HARIVKURFQYWBH-UHFFFAOYSA-N

Product Name

2-METHOXY-[1,1'-BIPHENYL]-4-AMINE

3-Methoxy-4-phenylaniline Specification

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