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10578-75-3

Basic Information
CAS No.: 10578-75-3
Name: 2-(Benzyloxy)-1-ethanamine hydrochloride
Article Data: 4
Molecular Structure:
Molecular Structure of 10578-75-3 (2-(Benzyloxy)-1-ethanamine hydrochloride)
Formula: C9H14ClNO
Molecular Weight: 187.669
Synonyms: 2-Benzyloxyethylamine hydrochloride;2-(Benzyloxy)ethanamine hydrochloride;Ethanamine,2-(phenylmethoxy)-, hydrochloride (9CI);Ethylamine, 2-(benzyloxy)-,hydrochloride (7CI,8CI);2-(Phenylmethoxy)ethylammonium chloride;Ethanamine,2-(phenylmethoxy)-, hydrochloride (1:1);
Melting Point: 142 °C
Boiling Point: 240.6 °C at 760 mmHg
Flash Point: 84.9 °C
Hazard Symbols: IrritantXi
Risk Codes:  Xi:Harmful;
">  Xi:Harmful;
Safety: 26-36
PSA: 35.25000
LogP: 2.66420
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Specification

The 2-(Benzyloxy)-1-ethanamine hydrochloride, with the CAS registry number 10578-75-3, is also known as 2-(Phenylmethoxy)ethylammonium chloride. It belongs to the product category of Phenyls & Phenyl-Het. This chemical's molecular formula is C9H14ClNO and molecular weight is 187.67. What's more, its systematic name is 2-(benzyloxy)ethanamine hydrochloride. 

Physical properties of 2-(Benzyloxy)-1-ethanamine hydrochloride are: (1)ACD/LogP: 1.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.47; (4)ACD/LogD (pH 7.4): -0.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5.26; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 12.47 Å2; (12)Flash Point: 84.9 °C; (13)Enthalpy of Vaporization: 47.75 kJ/mol; (14)Boiling Point: 240.6 °C at 760 mmHg; (15)Vapour Pressure: 0.0376 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O(CCN)Cc1ccccc1
(2)InChI: InChI=1S/C9H13NO.ClH/c10-6-7-11-8-9-4-2-1-3-5-9;/h1-5H,6-8,10H2;1H
(3)InChIKey: AFQMWBUNDONXED-UHFFFAOYSA-N