Piperazine,1-(2-chloroethyl)-4-(2-methoxyphenyl)- supplier

Name
1-(2-METHOXYPHENYL)-4-(2-CHLOROETHYL)PIPERAZINE DIHYDROCHLORIDE
EINECS
CAS No. 43091-72-1
Article Data13
CAS DataBase
Density 1.128±0.06 g/cm3(Predicted)
Solubility
Melting Point 240 °C
Formula C₁₃H₂₁Cl₃N₂O
Boiling Point 374 °C at 760 mmHg
Molecular Weight 254.76
Flash Point 180 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1-(2-Chloroethyl)-4-(2-methoxyphenyl)piperazine;
PSA 15.71000
LogP 3.66290

Piperazine,1-(2-chloroethyl)-4-(2-methoxyphenyl)- Specification

The Piperazine,1-(2-chloroethyl)-4-(2-methoxyphenyl)-, with the CAS registry number 43091-72-1, is also known as 1-(2-Methoxyphenyl)-4-(2-chloroethyl)piperazine. This chemical's molecular formula is C₁₃H₂₁Cl₃N₂O and molecular weight is 327.68. Its systematic name is called 1-(2-chloroethyl)-4-(2-methoxyphenyl)piperazinediium dichloride.

Physical properties of Piperazine,1-(2-chloroethyl)-4-(2-methoxyphenyl)-: (1)ACD/LogP: 2.42; (2)ACD/LogD (pH 5.5): 1.06; (3)ACD/LogD (pH 7.4): 2.3; (4)ACD/BCF (pH 5.5): 1.78; (5)ACD/BCF (pH 7.4): 31.26; (6)ACD/KOC (pH 5.5): 21.68; (7)ACD/KOC (pH 7.4): 380.4; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 4; (10)Flash Point: 180 °C; (11)Enthalpy of Vaporization: 62.13 kJ/mol; (12)Boiling Point: 374 °C at 760 mmHg; (13)Vapour Pressure: 8.61E-06 mmHg at 25°C.

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

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[Cl-].ClCC[NH+]2CC[NH+](c1c(OC)cccc1)CC2
(2)InChI: InChI=1/C13H19ClN2O.2ClH/c1-17-13-5-3-2-4-12(13)16-10-8-15(7-6-14)9-11-16;;/h2-5H,6-11H2,1H3;2*1H
(3)InChIKey: VAZCTMNZAXXBKW-UHFFFAOYAB

Product Name

1-(2-METHOXYPHENYL)-4-(2-CHLOROETHYL)PIPERAZINE DIHYDROCHLORIDE

Piperazine,1-(2-chloroethyl)-4-(2-methoxyphenyl)- Specification

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