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3619-73-6

Basic Information
CAS No.: 3619-73-6
Name: 1-Ethylhomopiperazine
Article Data: 9
Molecular Structure:
Molecular Structure of 3619-73-6 (1-Ethylhomopiperazine)
Formula: C7H16N2
Molecular Weight: 128.217
Synonyms: 1-Ethyl-1,4-diazepane;1-Ethyl-[1,4]diazepane;1-Ethyl-1,4-diazaperhydroepine;
EINECS: -0
Density: 0.861 g/cm3
Boiling Point: 175 °C at 760 mmHg
Flash Point: 59.2 °C
Hazard Symbols: R34:Causes burns.;
Risk Codes: 34
Safety: 26-36/37/39-45
PSA: 3.24000
LogP: 1.82020
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Specification

The 1-Ethylhomopiperazine, with the CAS registry number 3619-73-6, is also known as 1-Ethyl-1,4-diazaperhydroepine. This chemical's molecular formula is C7H16N2 and molecular weight is 128.22. What's more, its systematic name is 1-ethyl-1,4-diazepane. It is stable at common pressure and temperature, and it should be sealed and stored in a cool and dry place. What's more, it should be protected from light.

Physical properties of 1-Ethylhomopiperazine are: (1)ACD/LogP: 0.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.3; (4)ACD/LogD (pH 7.4): -2.22; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.44; (14)Molar Refractivity: 39.29 cm3; (15)Molar Volume: 148.8 cm3; (16)Polarizability: 15.57×10-24cm3; (17)Surface Tension: 25.7 dyne/cm; (18)Density: 0.861 g/cm3; (19)Flash Point: 59.2 °C; (20)Enthalpy of Vaporization: 41.13 kJ/mol; (21)Boiling Point: 175 °C at 760 mmHg; (22)Vapour Pressure: 1.17 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you must seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: N1CCCN(CC)CC1
(2)InChI: InChI=1S/C7H16N2/c1-2-9-6-3-4-8-5-7-9/h8H,2-7H2,1H3
(3)InChIKey: CWFLFGDTTKLLGN-UHFFFAOYSA-N