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| CAS No.: | 1882-72-0 |
|---|---|
| Name: | methyl 2-amino-5-hydroxybenzoate |
| Article Data: | 26 |
| Molecular Structure: | |
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| Formula: | C8H9NO3 |
| Molecular Weight: | 167.164 |
| Synonyms: | Anthranilic acid, 5-hydroxy-, methyl ester (7CI,8CI);2-Amino-5-hydroxybenzoic acid methyl ester;4-Amino-3-methoxycarbonylphenol;5-Hydroxyanthranilic acid methyl ester;Methyl 2-amino-5-hydroxybenzoate;Methyl 5-hydroxyanthranilate; |
| Density: | 1.305 g/cm3 |
| Melting Point: | 158.0 to 162.0 °C |
| Boiling Point: | 357.4 °C at 760 mmHg |
| Flash Point: | 170 °C |
| PSA: | 72.55000 |
| LogP: | 1.34220 |
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Specification
The Benzoicacid, 2-amino-5-hydroxy-, methyl ester, with the CAS registry number 1882-72-0, is also known as 2-Amino-5-hydroxybenzoic acid methyl ester. This chemical's molecular formula is C8H9NO3 and molecular weight is 167.16. What's more, its systematic name is Methyl 2-amino-5-hydroxybenzoate.
Physical properties of Benzoicacid, 2-amino-5-hydroxy-, methyl ester are: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 38.77 Å2; (7)Index of Refraction: 1.605; (8)Molar Refractivity: 44.14 cm3; (9)Molar Volume: 128 cm3; (10)Polarizability: 17.49×10-24 cm3; (11)Surface Tension: 57.7 dyne/cm; (12)Density: 1.305 g/cm3; (13)Flash Point: 170 °C; (14)Enthalpy of Vaporization: 62.65 kJ/mol; (15)Boiling Point: 357.4 °C at 760 mmHg; (16)Vapour Pressure: 1.33E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)c1cc(O)ccc1N
(2)InChI: InChI=1/C8H9NO3/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4,10H,9H2,1H3
(3)InChIKey: DWBKSTKVIIRFHL-UHFFFAOYSA-N