Name: 1-(3,4-Dimethoxyphenyl)piperazine hydrochloride
SKU: 16015-72-8

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Basic Information

Molecular Structure:
CAS No.:	16015-72-8
Name:	1-(3,4-Dimethoxyphenyl)piperazine hydrochloride

Formula:	C₁₂H₁₉ClN₂O₂
Molecular Weight:	258.74
Synonyms:	Piperazine,1-(3,4-dimethoxyphenyl)-, monohydrochloride (8CI,9CI);
Melting Point:	230 °C
Boiling Point:	381.7 °C at 760 mmHg
Flash Point:	184.7 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	33.73000
LogP:	2.30920

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Specification

The Piperazine,1-(3,4-dimethoxyphenyl)-, hydrochloride is an organic compound with the formula C₁₂H₁₈N₂O₂• HCl. The IUPAC name of this chemical is 1-(3,4-Dimethoxyphenyl)piperazine hydrochloride. With the CAS registry number 16015-72-8, it is also named as Dimethoxyphenylpiperazinehydrochlorid. The product's categories are Piperidines; Piperidones; Piperazines. Besides, its molecular weight is 258.74.

Physical properties about Piperazine,1-(3,4-dimethoxyphenyl)-, hydrochloride are: (1)ACD/LogP: 0.72; (2)ACD/LogD (pH 5.5): -2.04; (3)ACD/LogD (pH 7.4): -0.43; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 4.14; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 21.7 Å²; (12)Flash Point: 184.7 °C; (13)Enthalpy of Vaporization: 63 kJ/mol; (14)Boiling Point: 381.7 °C at 760 mmHg; (15)Vapour Pressure: 4.98E-06 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C12H18N2O2.ClH/c1-15-11-4-3-10(9-12(11)16-2)14-7-5-13-6-8-14;/h3-4,9,13H,5-8H2,1-2H3;1H
(2)InChIKey: WXLJIVYSDTVIHM-UHFFFAOYAJ
(3)Std. InChI: InChI=1S/C12H18N2O2.ClH/c1-15-11-4-3-10(9-12(11)16-2)14-7-5-13-6-8-14;/h3-4,9,13H,5-8H2,1-2H3;1H
(4)Std. InChIKey: WXLJIVYSDTVIHM-UHFFFAOYSA-N