Methyl 2-amino-3-chlorobenzoate

The Methyl 2-Amino-3-Chlorobenzoate is an organic compound with the formula C₈H₈ClNO₂. The IUPAC name of this chemical is methyl 2-amino-3-chlorobenzoate. With the CAS registry number 77820-58-7, it is also named as 2-Amino-3-chloro-benzoic acid methyl ester. The product's categories are Fine Chemical & Intermediates; Aromatic Esters; Organic acids. Besides, it is used as a medicine and pesticide intermediates.

Physical properties about Methyl 2-Amino-3-Chlorobenzoate are: (1)ACD/LogP: 3.18; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 153; (5)ACD/BCF (pH 7.4): 153; (6)ACD/KOC (pH 5.5): 1273; (7)ACD/KOC (pH 7.4): 1273; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 52.32 Å²; (12)Index of Refraction: 1.581; (13)Molar Refractivity: 47.157 cm³; (14)Molar Volume: 141.557 cm³; (15)Polarizability: 18.695×10^-24cm³; (16)Surface Tension: 48.635 dyne/cm; (17)Density: 1.311 g/cm³; (18)Flash Point: 119.392 °C; (19)Enthalpy of Vaporization: 51.216 kJ/mol; (20)Boiling Point: 273.803 °C at 760 mmHg; (21)Vapour Pressure: 0.006 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. 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: COC(=O)c1cccc(c1N)Cl
(2)InChI: InChI=1/C8H8ClNO2/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4H,10H2,1H3
(3)InChIKey: MSXSZFYRADEEJA-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C8H8ClNO2/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4H,10H2,1H3
(5)Std. InChIKey: MSXSZFYRADEEJA-UHFFFAOYSA-N