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CAS No.: | 148459-54-5 |
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Name: | (4-AMINO-3-METHOXYPHENYL)METHANOL |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C8H11NO2 |
Molecular Weight: | 153.181 |
Synonyms: | 4-Amino-3-methoxybenzylalcohol;4-Amino-3-methoxyphenylmethanol;[4-Amino-3-(methyloxy)phenyl]methanol; |
Density: | 1.2±0.1 g/cm3 |
Boiling Point: | 312.3±27.0 °C at 760 mmHg |
Flash Point: | 142.7±23.7 °C |
PSA: | 55.48000 |
LogP: | 1.35090 |
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The 4-Amino-3-methoxyphenylmethanol, with the CAS registry number 148459-54-5, is also known as [4-Amino-3-(methyloxy)phenyl]methanol. This chemical's molecular formula is C8H11NO2 and molecular weight is 153.18. What's more, its systematic name is (4-Amino-3-methoxyphenyl)methanol.
Physical properties of 4-Amino-3-methoxyphenylmethanol are: (1)ACD/LogP: -0.09±0.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.13; (4)ACD/LogD (pH 7.4): -0.09; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 19.38; (8)ACD/KOC (pH 7.4): 21.22; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.48 Å2; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 43.6±0.3 cm3; (15)Molar Volume: 129.5±3.0 cm3; (16)Polarizability: 17.3±0.5×10-24cm3; (17)Surface Tension: 49.3±3.0 dyne/cm; (18)Density: 1.2±0.1 g/cm3; (19)Flash Point: 142.7±23.7 °C; (20)Enthalpy of Vaporization: 58.4±3.0 kJ/mol; (21)Boiling Point: 312.3±27.0 °C at 760 mmHg; (22)Vapour Pressure: 0.0±0.7 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(ccc1N)CO
(2)Std. InChI: InChI=1S/C8H11NO2/c1-11-8-4-6(5-10)2-3-7(8)9/h2-4,10H,5,9H2,1H3
(3)Std. InChIKey: RVYSKGNWKIIUIF-UHFFFAOYSA-N