CAS No.138113-09-4,2-(7-Methoxynaphthalen-1-yl)ethanamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	138113-09-4
Name:	2-(7-Methoxynaphthalen-1-yl)ethanamine
Article Data:	23

Formula:	C₁₃H₁₅NO
Molecular Weight:	201.268
Synonyms:	2-(7-Methoxy-1-naphthyl)ethanamine;7-Methoxy-1-naphthaleneethanamine;2-(7-Methoxynaphthalen-1-yl)ethan-1-amine;
EINECS:	604-062-5
Density:	1.094 g/cm³
Boiling Point:	353.567 °C at 760 mmHg
Flash Point:	175.306 °C
PSA:	35.25000
LogP:	3.04990

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Specification

The 1-Naphthaleneethanamine, 7-methoxy-, with the CAS registry number 138113-09-4, is also known as 7-Methoxy-1-naphthaleneethanamine. This chemical's molecular formula is C₁₃H₁₅NO and molecular weight is 201.26. What's more, its systematic name is 2-(7-Methoxy-1-naphthyl)ethanamine.

Physical properties of 1-Naphthaleneethanamine, 7-methoxy- are: (1)ACD/LogP: 2.885; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.18; (4)ACD/LogD (pH 7.4): 0.62; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 4.77; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 35.25 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 63.858 cm³; (15)Molar Volume: 184.046 cm³; (16)Polarizability: 25.315×10^-24cm³; (17)Surface Tension: 43.7750015258789 dyne/cm; (18)Density: 1.094 g/cm³; (19)Flash Point: 175.306 °C; (20)Enthalpy of Vaporization: 59.851 kJ/mol; (21)Boiling Point: 353.567 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O(c2ccc1c(c(ccc1)CCN)c2)C
(2)Std. InChI:InChI=1S/C13H15NO/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12/h2-6,9H,7-8,14H2,1H3
(3)Std. InChIKey:YXDUMIVUPSVYLB-UHFFFAOYSA-N