Name: 2-METHOXYPHENAMINE HCL
SKU: 93-30-1

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Basic Information

Molecular Structure:
CAS No.:	93-30-1
Name:	2-METHOXYPHENAMINE HCL

Formula:	C₁₁H₁₇NO
Molecular Weight:	179.262
Synonyms:	Phenethylamine,o-methoxy-N,a-dimethyl-(7CI,8CI);1-(o-Methoxyphenyl)-2-methylaminopropane;2-Methoxy-N-methylamphetamine;2-Methoxymethamphetamine;Methoxiphenadrin;Methoxyphenadrine;Methoxyphenamin;Methoxyphenamine;Orthoxine;Ortodrinex;Ortoxine;dl-Methoxyphenamine;a-(2-Methoxyphenyl)-b-methylaminopropane;b-(o-Methoxyphenyl)isopropylmethylamine;
EINECS:	202-237-7
Density:	0.951 g/cm³
Melting Point:	271°C
Boiling Point:	252.3 °C at 760 mmHg
Flash Point:	102.6 °C
PSA:	21.26000
LogP:	2.23650

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Specification

The Benzeneethanamine,2-methoxy-N,a-dimethyl-, with the CAS registry number 93-30-1 and EINECS registry number 202-237-7, has the systematic name of 1-(2-methoxyphenyl)-N-methylpropan-2-amine. It is also called 2-Methoxy-N,a-dimethylbenzeneethanamime. And the molecular formula of this chemical is C₁₁H₁₇NO.

The physical properties of Benzeneethanamine,2-methoxy-N,a-dimethyl- are as following: (1)ACD/LogP: 1.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.23; (4)ACD/LogD (pH 7.4): -0.86; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.498; (14)Molar Refractivity: 55.29 cm³; (15)Molar Volume: 188.4 cm³; (16)Polarizability: 21.92×10^-24cm³; (17)Surface Tension: 31.2 dyne/cm; (18)Density: 0.951 g/cm³; (19)Flash Point: 102.6 °C; (20)Enthalpy of Vaporization: 48.97 kJ/mol; (21)Boiling Point: 252.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0194 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccccc1CC(NC)C)C
(2)InChI: InChI=1/C11H17NO/c1-9(12-2)8-10-6-4-5-7-11(10)13-3/h4-7,9,12H,8H2,1-3H3
(3)InChIKey: OEHAYUOVELTAPG-UHFFFAOYAK