Basic Information | Post buying leads | Suppliers |
Name |
4-(1-Piperazinyl)-1H-indole dihydrochloride |
EINECS | N/A |
CAS No. | 255714-24-0 | Density | 1.182g/cm3 |
PSA | 31.06000 | LogP | 3.57530 |
Solubility | N/A | Melting Point |
300-303 °C |
Formula | C12H17Cl2N3 | Boiling Point | 421.5 °C at 760 mmHg |
Molecular Weight | 237.732 | Flash Point | 208.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1H-Indole,4-(1-piperazinyl)-, dihydrochloride (9CI); |
The 1H-Indole,4-(1-piperazinyl)-, hydrochloride (1:2), with the CAS registry number 255714-24-0, is also known as 4-(1-Piperazinyl)-1H-indole 2HCl. It belongs to the product categories of API Intermediates; Pyrroles & Indoles. This chemical's molecular formula is C12H17Cl2N3 and molecular weight is 274.18948. Its IUPAC name is called 4-piperazin-1-yl-1H-indole dihydrochloride.
Physical properties of 1H-Indole,4-(1-piperazinyl)-, hydrochloride (1:2): (1)ACD/LogP: 1.04; (2)ACD/LogD (pH 5.5): -1.94; (3)ACD/LogD (pH 7.4): -0.59; (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): 2.07; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Flash Point: 208.7 °C; (12)Enthalpy of Vaporization: 67.56 kJ/mol; (13)Boiling Point: 421.5 °C at 760 mmHg; (14)Vapour Pressure: 2.59E-07 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)Canonical SMILES: C1CN(CCN1)C2=CC=CC3=C2C=CN3.Cl.Cl
(2)InChI: InChI=1S/C12H15N3.2ClH/c1-2-11-10(4-5-14-11)12(3-1)15-8-6-13-7-9-15;;/h1-5,13-14H,6-9H2;2*1H
(3)InChIKey: FHRAUNYCUBSDMF-UHFFFAOYSA-N