CAS No.106261-49-8,4-[(4-Methylpiperazin-1-yl)methyl]benzoic acid dihydrochloride Suppliers

Products Categories

Pharmaceutical (206)
Others (50)
Organic Chemicals (42)
Reagent (7)
Materials (2)
Food Additives (1)

Basic Information

Molecular Structure:
CAS No.:	106261-49-8
Name:	4-[(4-Methylpiperazin-1-yl)methyl]benzoic acid dihydrochloride

Formula:	C₁₃H₂₀Cl₂N₂O₂
Molecular Weight:	307.2161
Synonyms:	Benzoicacid, 4-[(4-methyl-1-piperazinyl)methyl]-, dihydrochloride (9CI);4-[(4-Methyl-1-piperazinyl)methyl]benzoicacid dihydrochloride;4-[(4-Methylpiperazin-1-yl)methyl]benzoic acid dihydrochloride 0.5 hydrate;Benzoic acid dihydrochloride;
EINECS:	600-728-4
Density:	1.345g/cm3
Melting Point:	305-307 °C
Boiling Point:	377.2 °C at 760 mmHg
Flash Point:	181.9 °C
Solubility:	Soluble in water
Appearance:	Powder
Hazard Symbols:	Xn
Risk Codes:	22-36/37/38
Safety:	22-26-36/37/39
PSA:	53.01000
LogP:	2.54770

Total:230 Page 1 of 7 1 2 3 4 5 6 …7 Next>>

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 106261-49-8

Specification

The CAS registry number of Benzoic acid,4-[(4-methyl-1-piperazinyl)methyl]-, hydrochloride (1:2) is 106261-49-8. The systematic name is 4-[(4-methylpiperazin-1-yl)methyl]benzoic acid dihydrochloride. In addition, the molecular formula is C₁₃H₂₀Cl₂N₂O₂. What's more, it belongs to the class of API Intermediates. And it should be stored in a cool and dry place.

Physical properties about Benzoic acid,4-[(4-methyl-1-piperazinyl)methyl]-, hydrochloride (1:2) are: (1)ACD/LogP: 0.60; (2)ACD/LogD (pH 5.5): -1.89; (3)ACD/LogD (pH 7.4): -1.96; (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): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 32.78 Å²; (12)Flash Point: 181.9 °C; (13)Enthalpy of Vaporization: 65.92 kJ/mol; (14)Boiling Point: 377.2 °C at 760 mmHg; (15)Vapour Pressure: 2.32E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed. It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. And you should not breathe dust. 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)SMILES: Cl.Cl.O=C(O)c1ccc(cc1)CN2CCN(CC2)C
(2)InChI: InChI=1/C13H18N2O2.2ClH/c1-14-6-8-15(9-7-14)10-11-2-4-12(5-3-11)13(16)17;;/h2-5H,6-10H2,1H3,(H,16,17);2*1H
(3)InChIKey: ISHROKOWRJDOSN-UHFFFAOYAL