4-Bromo-2-methoxyaniline supplier

Name
4-BROMO-2-METHOXY-PHENYLAMINE
EINECS 200-002-4
CAS No. 59557-91-4
Article Data42
CAS DataBase
Density 1.531 g/cm³
Solubility
Melting Point 59 °C
Formula C₇H₈BrNO
Boiling Point 250.4 °C at 760 mmHg
Molecular Weight 202.051
Flash Point 105.2 °C
Transport Information UN2811
Appearance
Safety 36/37
Risk Codes 22-43-52
Molecular Structure
Hazard Symbols Xn
Synonyms o-Anisidine,4-bromo- (6CI);2-Amino-5-bromoanisole;2-Methoxy-4-bromoaniline;4-Bromo-2-methoxyaniline;4-Bromo-2-methoxyphenylamine;4-Bromo-o-anisidine;
PSA 35.25000
LogP 2.62110

4-Bromo-2-methoxyaniline Specification

This chemical is called Benzenamine,4-bromo-2-methoxy-, and its systematic name is 4-bromo-2-methoxyaniline. With the molecular formula of C₇H₈BrNO, its molecular weight is 202.05. The CAS registry number of this chemical is 59557-91-4. Additionally, its product category is Aniline.

Other characteristics of the Benzenamine,4-bromo-2-methoxy- can be summarised as followings: (1)ACD/LogP: 2.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.32; (4)ACD/LogD (pH 7.4): 2.33; (5)ACD/BCF (pH 5.5): 33.78; (6)ACD/BCF (pH 7.4): 34.49; (7)ACD/KOC (pH 5.5): 429.71; (8)ACD/KOC (pH 7.4): 438.84; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 44.85 cm³; (15)Molar Volume: 131.9 cm³; (16)Polarizability: 17.78×10^-24cm³; (17)Surface Tension: 44.2 dyne/cm; (18)Density: 1.531 g/cm³; (19)Flash Point: 105.2 °C; (20)Enthalpy of Vaporization: 48.76 kJ/mol; (21)Boiling Point: 250.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0218 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Brc1cc(OC)c(N)cc1
2.InChI: InChI=1/C7H8BrNO/c1-10-7-4-5(8)2-3-6(7)9/h2-4H,9H2,1H3
3.InChIKey: WRFYIYOXJWKONR-UHFFFAOYAZ

Product Name

4-BROMO-2-METHOXY-PHENYLAMINE

4-Bromo-2-methoxyaniline Specification

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