Methyl 6-amino-5-bromonicotinate supplier

Name
Methyl 6-amino-5-bromonicotinate
EINECS
CAS No. 180340-70-9
Article Data10
CAS DataBase
Density 1.662 g/cm³
Solubility
Melting Point 166-168 °C
Formula C₇H₇BrN₂O₂
Boiling Point 323.691 °C at 760 mmHg
Molecular Weight 231.049
Flash Point 149.563 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms methyl 6-amino-5-bromo-1H-pyridine-3-carboxylate;
PSA 65.21000
LogP 1.79410

Methyl 6-amino-5-bromonicotinate Specification

This chemical is called Methyl 6-amino-5-bromonicotinate, and it can also be named as 3-pyridinecarboxylic acid, 6-amino-5-bromo-, methyl ester. With the molecular formula of C₇H₇BrN₂O₂, its molecular weight is 231.05. The CAS registry number of this chemical is 180340-70-9, and its product categories are Amines; Blocks; Bromides; Carboxes; Pyridines; Esters; Pyridine.

Other characteristics of the Methyl 6-amino-5-bromonicotinate can be summarised as followings: (1)ACD/LogP: 2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.69; (4)ACD/LogD (pH 7.4): 2.69; (5)ACD/BCF (pH 5.5): 65.58; (6)ACD/BCF (pH 7.4): 65.6; (7)ACD/KOC (pH 5.5): 695.03; (8)ACD/KOC (pH 7.4): 695.26; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.43 Å²; (13)Index of Refraction: 1.607; (14)Molar Refractivity: 48.04 cm³; (15)Molar Volume: 139 cm³; (16)Polarizability: 19.04×10^-24cm³; (17)Surface Tension: 57.3 dyne/cm; (18)Density: 1.662 g/cm³; (19)Flash Point: 149.6 °C; (20)Enthalpy of Vaporization: 56.57 kJ/mol; (21)Boiling Point: 323.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000258 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Brc1cc(C(=O)OC)cnc1N
2.InChI: InChI=1/C7H7BrN2O2/c1-12-7(11)4-2-5(8)6(9)10-3-4/h2-3H,1H3,(H2,9,10)
3.InChIKey: LNTAAMVZKGYIIA-UHFFFAOYAC

Product Name

Methyl 6-amino-5-bromonicotinate

Methyl 6-amino-5-bromonicotinate Specification

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