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N,N-dibutyloct-2-yn-1-amine

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Name

N,N-dibutyloct-2-yn-1-amine

EINECS N/A
CAS No. 66894-61-9 Density 0.838 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C16H31N Boiling Point 312.5 °C at 760 mmHg
Molecular Weight 237.424 Flash Point 130 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 66894-61-9 (N,N-dibutyloct-2-yn-1-amine) Hazard Symbols N/A
Synonyms

N/A

Article Data 2

N,N-dibutyloct-2-yn-1-amine Specification

This chemical is called N,N-dibutyloct-2-yn-1-amine. With the molecular formula of C16H31N, its molecular weight is 237.424. The CAS registry number of this chemical is 66894-61-9. In addition, its systematic name is N,N-dibutyloct-2-yn-1-amine.

Other characteristics of the N,N-dibutyloct-2-yn-1-amine can be summarised as follows: (1)ACD/LogP: 6.22; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 11; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.462; (8)Molar Refractivity: 77.9 cm3; (9)Molar Volume: 283.2 cm3; (10)Polarizability: 30.88×10-24 cm3; (11)Surface Tension: 31.8 dyne/cm; (12)Density: 0.838 g/cm3; (13)Flash Point: 130 °C; (14)Enthalpy of Vaporization: 55.35 kJ/mol; (15)Boiling Point: 312.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000528 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: C(#CCN(CCCC)CCCC)CCCCC
2.InChI: InChI=1/C16H31N/c1-4-7-10-11-12-13-16-17(14-8-5-2)15-9-6-3/h4-11,14-16H2,1-3H3
3.InChIKey: BVCNCARQUAGZHF-UHFFFAOYAS

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