Essay on Data Type

dihydronaphthalene C10H10 structure

Molecular Formula C10H10 Average mass 130.186 Da Density 1.0±0.1 g/cm3 Boiling Point 204.9±15.0 °C at 760 mmHg Flash Point 67.2±0.0 °C Molar Refractivity 42.6±0.3 cm3 Polarizability 16.9±0.5 10-24cm3 Surface Tension 39.6±3.0 dyne/cm Molar Volume 129.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Cycloheptane C7H14 structure

Molecular Formula C7H14 Average mass 98.186 Da Density 0.8±0.1 g/cm3 Boiling Point 118.5±7.0 °C at 760 mmHg Flash Point 6.1±0.0 °C Molar Refractivity 32.3±0.3 cm3 Polarizability 12.8±0.5 10-24cm3 Surface Tension 25.9±3.0 dyne/cm Molar Volume 124.2±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Cyclopentane C5H10 structure

Molecular Formula C5H10 Average mass 70.133 Da Density 0.8±0.1 g/cm3 Boiling Point 49.2±0.0 °C at 760 mmHg Flash Point -37.2±0.0 °C Molar Refractivity 23.1±0.3 cm3 Polarizability 9.1±0.5 10-24cm3 Surface Tension 25.9±3.0 dyne/cm Molar Volume 88.7±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Methanol CH4O structure

Molecular Formula CH4O Average mass 32.042 Da Density 0.8±0.1 g/cm3 Boiling Point 48.1±3.0 °C at 760 mmHg Flash Point 11.1±0.0 °C Molar Refractivity 8.2±0.3 cm3 Polarizability 3.3±0.5 10-24cm3 Surface Tension 18.9±3.0 dyne/cm Molar Volume 42.5±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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nonanol C9H20O structure

Molecular Formula C9H20O Average mass 144.255 Da Density 0.8±0.1 g/cm3 Boiling Point 211.6±3.0 °C at 760 mmHg Flash Point 97.8±0.0 °C Molar Refractivity 45.3±0.3 cm3 Polarizability 18.0±0.5 10-24cm3 Surface Tension 29.5±3.0 dyne/cm Molar Volume 174.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Mesityl oxide C6H10O structure

Molecular Formula C6H10O Average mass 98.143 Da Density 0.8±0.1 g/cm3 Boiling Point 132.7±9.0 °C at 760 mmHg Flash Point 30.6±0.0 °C Molar Refractivity 29.8±0.3 cm3 Polarizability 11.8±0.5 10-24cm3 Surface Tension 23.2±3.0 dyne/cm Molar Volume 118.1±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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METHYLPYRROLIDINE C5H11N structure

Molecular Formula C5H11N Average mass 85.147 Da Density 0.9±0.1 g/cm3 Boiling Point 82.1±3.0 °C at 760 mmHg Flash Point -21.7±0.0 °C Molar Refractivity 26.7±0.3 cm3 Polarizability 10.6±0.5 10-24cm3 Surface Tension 26.8±3.0 dyne/cm Molar Volume 99.8±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Heptylacetat C9H18O2 structure

Molecular Formula C9H18O2 Average mass 158.238 Da Density 0.9±0.1 g/cm3 Boiling Point 191.6±3.0 °C at 760 mmHg Flash Point 68.6±6.9 °C Molar Refractivity 45.5±0.3 cm3 Polarizability 18.0±0.5 10-24cm3 Surface Tension 27.9±3.0 dyne/cm Molar Volume 180.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Methyl laurate C13H26O2 structure

Molecular Formula C13H26O2 Average mass 214.344 Da Density 0.9±0.1 g/cm3 Boiling Point 263.0±3.0 °C at 760 mmHg Flash Point 114.6±6.9 °C Molar Refractivity 64.1±0.3 cm3 Polarizability 25.4±0.5 10-24cm3 Surface Tension 29.4±3.0 dyne/cm Molar Volume 246.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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hexanethiol C6H14S structure

Molecular Formula C6H14S Average mass 118.240 Da Density 0.8±0.1 g/cm3 Boiling Point 152.3±3.0 °C at 760 mmHg Flash Point 20.6±0.0 °C Molar Refractivity 37.7±0.3 cm3 Polarizability 15.0±0.5 10-24cm3 Surface Tension 27.0±3.0 dyne/cm Molar Volume 141.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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1-Bromohexane C6H13Br structure

Molecular Formula C6H13Br Average mass 165.071 Da Density 1.2±0.1 g/cm3 Boiling Point 154.9±3.0 °C at 760 mmHg Flash Point 57.2±0.0 °C Molar Refractivity 37.6±0.3 cm3 Polarizability 14.9±0.5 10-24cm3 Surface Tension 27.7±3.0 dyne/cm Molar Volume 140.8±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Methyl octylate C9H18O2 structure

Molecular Formula C9H18O2 Average mass 158.238 Da Density 0.9±0.1 g/cm3 Boiling Point 191.1±3.0 °C at 760 mmHg Flash Point 72.8±0.0 °C Molar Refractivity 45.5±0.3 cm3 Polarizability 18.0±0.5 10-24cm3 Surface Tension 27.9±3.0 dyne/cm Molar Volume 180.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Indole C8H7N structure

Molecular Formula C8H7N Average mass 117.148 Da Density 1.1±0.1 g/cm3 Boiling Point 253.0±9.0 °C at 760 mmHg Flash Point 107.8±11.3 °C Molar Refractivity 38.5±0.3 cm3 Polarizability 15.3±0.5 10-24cm3 Surface Tension 49.9±3.0 dyne/cm Molar Volume 101.9±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Pent-1-ene C5H10 structure

Molecular Formula C5H10 Average mass 70.133 Da Density 0.7±0.1 g/cm3 Boiling Point 29.9±3.0 °C at 760 mmHg Flash Point -28.9±0.0 °C Molar Refractivity 24.9±0.3 cm3 Polarizability 9.9±0.5 10-24cm3 Surface Tension 18.5±3.0 dyne/cm Molar Volume 106.2±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Experimental Physico-chemical Properties Experimental Melting Point: -138 °C […]

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Propyl acetate C5H10O2 structure

Molecular Formula C5H10O2 Average mass 102.132 Da Density 0.9±0.1 g/cm3 Boiling Point 101.4±3.0 °C at 760 mmHg Flash Point 12.8±0.0 °C Molar Refractivity 27.0±0.3 cm3 Polarizability 10.7±0.5 10-24cm3 Surface Tension 24.9±3.0 dyne/cm Molar Volume 114.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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Bromobenzene C6H5Br structure

Molecular Formula C6H5Br Average mass 157.008 Da Density 1.5±0.1 g/cm3 Boiling Point 154.2±9.0 °C at 760 mmHg Flash Point 51.1±0.0 °C Molar Refractivity 33.9±0.3 cm3 Polarizability 13.5±0.5 10-24cm3 Surface Tension 35.5±3.0 dyne/cm Molar Volume 105.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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2,2,4-trimethyl-3-pentene C8H16 structure

Molecular Formula C8H16 Average mass 112.213 Da Density 0.7±0.1 g/cm3 Boiling Point 104.9±0.0 °C at 760 mmHg Flash Point -1.7±0.0 °C Molar Refractivity 39.0±0.3 cm3 Polarizability 15.5±0.5 10-24cm3 Surface Tension 20.8±3.0 dyne/cm Molar Volume 154.1±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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butadiene C4H6 structure

Molecular Formula C4H6 Average mass 54.090 Da Density 0.6±0.1 g/cm3 Boiling Point -4.4±0.0 °C at 760 mmHg Flash Point -76.1±0.0 °C Molar Refractivity 20.0±0.3 cm3 Polarizability 7.9±0.5 10-24cm3 Surface Tension 15.9±3.0 dyne/cm Molar Volume 84.8±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Experimental Physico-chemical Properties Experimental Melting Point: -109 °C […]

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Propyl propanoate C6H12O2 structure

Molecular Formula C6H12O2 Average mass 116.158 Da Density 0.9±0.1 g/cm3 Boiling Point 121.9±3.0 °C at 760 mmHg Flash Point 19.4±0.0 °C Molar Refractivity 31.6±0.3 cm3 Polarizability 12.5±0.5 10-24cm3 Surface Tension 25.9±3.0 dyne/cm Molar Volume 131.1±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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n-Ethyl propanoate C5H10O2 structure

Molecular Formula C5H10O2 Average mass 102.132 Da Density 0.9±0.1 g/cm3 Boiling Point 95.9±3.0 °C at 760 mmHg Flash Point 12.2±0.0 °C Molar Refractivity 27.0±0.3 cm3 Polarizability 10.7±0.5 10-24cm3 Surface Tension 24.9±3.0 dyne/cm Molar Volume 114.6±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Predicted – Mcule Experimental Physico-chemical Properties Experimental Melting […]

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UNII:U8933MB30H C6H14O structure

Molecular Formula C6H14O Average mass 102.175 Da Density 0.8±0.1 g/cm3 Boiling Point 148.0±0.0 °C at 760 mmHg Flash Point 50.6±0.0 °C Molar Refractivity 31.3±0.3 cm3 Polarizability 12.4±0.5 10-24cm3 Surface Tension 26.6±3.0 dyne/cm Molar Volume 125.5±3.0 cm3 Experimental data Predicted – ACD/Labs Predicted – EPISuite Predicted – ChemAxon Experimental Physico-chemical Properties Experimental Flash Point: 41 °C […]

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