-
Name
3-(CYCLOPENTYLAMINO)PROPIONITRILE
- EINECS
- CAS No. 1074-63-1
- Article Data7
- CAS DataBase
- Density 0.95 g/cm3
- Solubility
- Melting Point
- Formula C8H14N2
- Boiling Point 265.8 °C at 760 mmHg
- Molecular Weight 138.213
- Flash Point 114.5 °C
- Transport Information
- Appearance
- Safety 26-36/37/39
- Risk Codes 20/21/22
-
Molecular Structure
- Hazard Symbols
- Synonyms Propionitrile,3-(cyclopentylamino)- (7CI,8CI);
- PSA 35.82000
- LogP 1.82318
Propanenitrile,3-(cyclopentylamino)- Specification
The CAS registry number of Propanenitrile,3-(cyclopentylamino)- is 1074-63-1. This chemical is also named as 3-(Cyclopentylamino)propionitrile. In addition, its molecular formula is C8H14N2 and molecular weight is 138.21. Its systematic name and IUPAC name are the same which is called 3-(cyclopentylamino)propanenitrile.
Physical properties about Propanenitrile,3-(cyclopentylamino)- are: (1)ACD/LogP: 0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.11; (4)ACD/LogD (pH 7.4): -0.55; (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): 3.22; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.474; (13)Molar Refractivity: 40.61 cm3; (14)Molar Volume: 144.4 cm3; (15)Surface Tension: 37 dyne/cm; (16)Density: 0.95 g/cm3; (17)Flash Point: 114.5 °C; (18)Enthalpy of Vaporization: 50.37 kJ/mol; (19)Boiling Point: 265.8 °C at 760 mmHg; (20)Vapour Pressure: 0.00897 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed.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: N#CCCNC1CCCC1
(2)InChI: InChI=1/C8H14N2/c9-6-3-7-10-8-4-1-2-5-8/h8,10H,1-5,7H2
(3)InChIKey: YHGZCPAPXDXHCY-UHFFFAOYAF
Related Products
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- Propanenitrile,3-(2-methoxyethoxy)-
- Propanenitrile,3-(butylamino)-
- Propanenitrile,3-(cyclohexylamino)-
- Propanenitrile,3-(cyclopentylamino)-
- Propanenitrile,3-(cyclopropylamino)-
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