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2-(Tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride

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Name

2-(Tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride

EINECS N/A
CAS No. 1005756-81-9 Density N/A
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C7H15NO.HCl Boiling Point 241.4 °C at 760 mmHg
Molecular Weight 165.66 Flash Point 99.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes  Xi:;
Molecular Structure Molecular Structure of 1005756-81-9 (2H-Pyran-2-ethanamine,tetrahydro-, hydrochloride (1:1)) Hazard Symbols IrritantXi
Synonyms

2-(tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride;

 

2-(Tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride Specification

The 2-(Tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride, with CAS registry number 1005756-81-9, belongs to the following product category: Chiral Chemicals. It has the systematic name of 2-(tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride. Besides this, it is also called 2H-Pyran-2-ethanamine, tetrahydro-, hydrochloride (1:1). And the chemical formula of this chemical is C7H15NO.HCl.

Physical properties of 2-(Tetrahydro-2H-pyran-2-yl)ethanamine hydrochloride: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 35.25 Å2; (11)Enthalpy of Vaporization: 48.8 kJ/mol; (12)Vapour Pressure: 0.0289 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NCCC1CCCCO1.Cl
(2)InChI: InChI=1/C7H15NO.ClH/c8-5-4-7-3-1-2-6-9-7;/h7H,1-6,8H2;1H
(3)InChIKey: VLQAPJJITJTNJR-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C7H15NO.ClH/c8-5-4-7-3-1-2-6-9-7;/h7H,1-6,8H2;1H
(5)Std. InChIKey: VLQAPJJITJTNJR-UHFFFAOYSA-N

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