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| CAS No.: | 5654-83-1 |
|---|---|
| Name: | (+/-)-1,4-DIAZABICYCLO[4.4.0]DECANE |
| Molecular Structure: | |
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| Formula: | C7H14N2 |
| Molecular Weight: | 126.202 |
| Synonyms: | 1,2,3,4,6,7,8,8a-Octahydropyrrolo[1,2-a]pyrazine;1,2-Trimethylenepiperazine;1,4-Diazabicyclo[4.3.0]nonane;Octahydropyrrolo[1,2-a]pyrazine; |
| Density: | 1.03 g/cm3 |
| Boiling Point: | 199.639 °C at 760 mmHg |
| Flash Point: | 88.833 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 15.27000 |
| LogP: | 0.32070 |
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Specification
The CAS register number of Pyrrolo[1,2-a]pyrazine,octahydro- is 5654-83-1. It also can be called as 1,4-diazabicyclo[4.3.0]nonane and the systematic name about this chemical is octahydropyrrolo[1,2-a]pyrazine. The molecular formula about this chemical is C7H14N2 and the molecular weight is 126.2. It belongs to the Heterocycles series.
Physical properties about Pyrrolo[1,2-a]pyrazine,octahydro- are: (1)ACD/LogP: 0.14; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)Polar Surface Area: 15.27Å2; (9)Index of Refraction: 1.534; (10)Molar Refractivity: 37.879 cm3; (11)Molar Volume: 121.86 cm3; (12)Polarizability: 15.016x10-24cm3; (13)Surface Tension: 38.642 dyne/cm; (14)Flash Point: 88.833 °C; (15)Enthalpy of Vaporization: 43.584 kJ/mol; (16)Boiling Point: 199.639 °C at 760 mmHg; (17)Vapour Pressure: 0.338 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical 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)SMILES: C1CC2CNCCN2C1
(2)InChI: InChI=1/C7H14N2/c1-2-7-6-8-3-5-9(7)4-1/h7-8H,1-6H2
(3)InChIKey: FTTATHOUSOIFOQ-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C7H14N2/c1-2-7-6-8-3-5-9(7)4-1/h7-8H,1-6H2
(5)Std. InChIKey: FTTATHOUSOIFOQ-UHFFFAOYSA-N