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CAS No.: | 22604-07-5 |
---|---|
Name: | 1-Naphthalenol,6-methoxy- |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C11H10O2 |
Molecular Weight: | 174.199 |
Synonyms: | 1-Naphthol,6-methoxy- (6CI,7CI,8CI);1-Hydroxy-6-methoxynaphthalene;6-Methoxy-1-naphthol;6-Methoxynaphthalen-1-ol; |
EINECS: | 200-589-5 |
Density: | 1.193 g/cm3 |
Melting Point: | 85 °C(Solv: ligroine (8032-32-4)) |
Boiling Point: | 336.678 °C at 760 mmHg |
Flash Point: | 211.849 °C |
PSA: | 29.46000 |
LogP: | 2.55400 |
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The 1-Naphthalenol,6-methoxy-, with CAS registry number 22604-07-5, has the systematic name of 6-methoxynaphthalen-1-ol. Besides this, it is also called 6-Methoxy-1-naphthol. And the chemical formula of this chemical is C11H10O2.
Physical properties of 1-Naphthalenol,6-methoxy-: (1)ACD/LogP: 2.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.43; (4)ACD/LogD (pH 7.4): 2.42; (5)ACD/BCF (pH 5.5): 41.23; (6)ACD/BCF (pH 7.4): 40.67; (7)ACD/KOC (pH 5.5): 498.62; (8)ACD/KOC (pH 7.4): 491.87; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.64; (14)Molar Refractivity: 52.65 cm3; (15)Molar Volume: 145.9 cm3; (16)Polarizability: 20.87×10-24cm3; (17)Surface Tension: 47.2 dyne/cm; (18)Density: 1.193 g/cm3; (19)Flash Point: 211.9 °C; (20)Enthalpy of Vaporization: 60.28 kJ/mol; (21)Boiling Point: 336.7 °C at 760 mmHg; (22)Vapour Pressure: 5.65E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc2cccc1cc(ccc12)OC
(2)InChI: InChI=1/C11H10O2/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h2-7,12H,1H3
(3)InChIKey: LPPSENSUXVOOII-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C11H10O2/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h2-7,12H,1H3
(5)Std. InChIKey: LPPSENSUXVOOII-UHFFFAOYSA-N