Chemical Properties of Formic acid, butyl ester (CAS 592-84-7)

Formic acid, butyl ester

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InChI
InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3
InChI Key
NMJJFJNHVMGPGM-UHFFFAOYSA-N
Formula
C5H10O2
SMILES
CCCCOC=O
Molecular Weight1
102.13
CAS
592-84-7
Other Names
  • BUTYL ESTER FORMIC ACID
  • Butyl formate
  • Butyl methanoate
  • Butylester kyseliny mravenci
  • HCOO(CH2)3CH3
  • UN 1128
  • butyl acetate
  • methanoic acid, butyl ester
  • n-Butyl formate
  • n-Butyl methanoate

Physical Properties

Property Value Unit Source
PAff 806.00 kJ/mol NIST
BasG 775.00 kJ/mol NIST
Δf -213.30 kJ/mol Joback Calculated Property
Δfgas -364.33 kJ/mol Joback Calculated Property
Δfus 12.18 kJ/mol Joback Calculated Property
Δvap [37.10; 41.30] kJ/mol Show Hide
Δvap 41.16 kJ/mol NIST
Δvap 40.10 kJ/mol NIST
Δvap 41.30 ± 0.10 kJ/mol NIST
Δvap 37.10 ± 0.04 kJ/mol NIST
IE [10.50; 10.54] eV Show Hide
IE 10.52 ± 0.02 eV NIST
IE 10.52 ± 0.05 eV NIST
IE 10.54 eV NIST
IE 10.50 ± 0.02 eV NIST
IE 10.52 eV NIST
log10WS [-1.37; -1.37]   Show Hide
log10WS -1.37 Aq. Sol...
log10WS -1.37 Estimat...
logPoct/wat 0.959 Crippen Calculated Property
McVol 88.750 ml/mol McGowan Calculated Property
NFPA Fire 3 KDB
NFPA Health 2 KDB
Pc 3713.49 kPa Joback Calculated Property
Inp [680.00; 737.00]   Show Hide
Inp 684.00 NIST
Inp 680.00 NIST
Inp 707.00 NIST
Inp 703.00 NIST
Inp 680.00 NIST
Inp 707.00 NIST
Inp 737.00 NIST
Inp 737.00 NIST
Inp 706.00 NIST
Inp 707.00 NIST
Inp 706.00 NIST
Inp 707.00 NIST
Inp 724.00 NIST
Inp 737.00 NIST
Inp 696.00 NIST
Inp 708.00 NIST
Inp 711.00 NIST
Inp 711.00 NIST
Inp 708.00 NIST
Inp 701.00 NIST
Inp 696.00 NIST
Inp 701.00 NIST
Inp 684.00 NIST
Inp 737.00 NIST
Inp 707.00 NIST
I [996.00; 1033.00]   Show Hide
I 1010.00 NIST
I 996.00 NIST
I 1033.00 NIST
I 996.00 NIST
I 1020.00 NIST
I 996.00 NIST
Tboil [378.75; 443.00] K Show Hide
Tboil 380.13 ± 0.02 K Solutio...
Tboil 380.13 K Solutio...
Tboil 379.33 K Vapor-L...
Tboil 380.13 K Isobari...
Tboil 380.00 K NIST
Tboil 379.30 K NIST
Tboil 379.75 ± 0.30 K NIST
Tboil 379.75 ± 0.30 K NIST
Tboil Outlier 443.00 ± 2.00 K NIST
Tboil 379.95 ± 0.50 K NIST
Tboil 379.80 ± 0.60 K NIST
Tboil 379.80 ± 0.50 K NIST
Tboil 379.85 ± 1.00 K NIST
Tboil 378.75 ± 1.00 K NIST
Tboil 380.00 ± 0.20 K NIST
Tboil 380.10 ± 1.50 K NIST
Tc 565.20 K NIST
Tfus [181.40; 183.20] K Show Hide
Tfus 181.40 K Aq. Sol...
Tfus 183.15 ± 1.50 K NIST
Tfus 183.20 ± 0.40 K NIST
Vc 0.350 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [165.62; 210.97] J/mol×K [384.88; 558.32] Show Hide
Cp,gas 165.62 J/mol×K 384.88 Joback Calculated Property
Cp,gas 173.77 J/mol×K 413.79 Joback Calculated Property
Cp,gas 181.68 J/mol×K 442.69 Joback Calculated Property
Cp,gas 189.36 J/mol×K 471.60 Joback Calculated Property
Cp,gas 196.81 J/mol×K 500.50 Joback Calculated Property
Cp,gas 204.01 J/mol×K 529.41 Joback Calculated Property
Cp,gas 210.97 J/mol×K 558.32 Joback Calculated Property
Cp,liquid 200.25 J/mol×K 298.15 NIST
η [0.0002907; 0.0030878] Pa×s [210.34; 384.88] Show Hide
η 0.0030878 Pa×s 210.34 Joback Calculated Property
η 0.0016395 Pa×s 239.43 Joback Calculated Property
η 0.0009985 Pa×s 268.52 Joback Calculated Property
η 0.0006700 Pa×s 297.61 Joback Calculated Property
η 0.0004827 Pa×s 326.70 Joback Calculated Property
η 0.0003669 Pa×s 355.79 Joback Calculated Property
η 0.0002907 Pa×s 384.88 Joback Calculated Property
ΔvapH [36.58; 40.10] kJ/mol [313.00; 379.30] Show Hide
ΔvapH 40.10 ± 0.10 kJ/mol 313.00 NIST
ΔvapH 39.00 ± 0.10 kJ/mol 328.00 NIST
ΔvapH 37.90 kJ/mol 337.50 NIST
ΔvapH 38.70 ± 0.10 kJ/mol 346.00 NIST
ΔvapH 38.10 ± 0.10 kJ/mol 355.00 NIST
ΔvapH 37.30 ± 0.10 kJ/mol 363.00 NIST
ΔvapH 36.58 kJ/mol 379.30 NIST
Pvap [7.98; 164.08] kPa [313.16; 395.48] Show Hide
Pvap 7.98 kPa 313.16 Vapor-L...
Pvap 10.19 kPa 318.33 Vapor-L...
Pvap 12.79 kPa 323.32 Vapor-L...
Pvap 16.08 kPa 328.57 Vapor-L...
Pvap 19.50 kPa 333.14 Vapor-L...
Pvap 19.50 kPa 333.15 Vapor-L...
Pvap 29.10 kPa 343.14 Vapor-L...
Pvap 29.10 kPa 343.15 Vapor-L...
Pvap 39.80 kPa 351.93 Vapor-L...
Pvap 41.34 kPa 352.90 Vapor-L...
Pvap 42.24 kPa 353.14 Vapor-L...
Pvap 42.24 kPa 353.15 Vapor-L...
Pvap 42.56 kPa 353.61 Vapor-L...
Pvap 44.01 kPa 354.63 Vapor-L...
Pvap 45.40 kPa 355.48 Vapor-L...
Pvap 46.69 kPa 356.16 Vapor-L...
Pvap 48.04 kPa 357.06 Vapor-L...
Pvap 49.58 kPa 357.83 Vapor-L...
Pvap 50.55 kPa 358.51 Vapor-L...
Pvap 51.34 kPa 358.67 Vapor-L...
Pvap 52.07 kPa 359.21 Vapor-L...
Pvap 53.37 kPa 360.03 Vapor-L...
Pvap 54.63 kPa 360.58 Vapor-L...
Pvap 56.03 kPa 361.30 Vapor-L...
Pvap 57.30 kPa 362.07 Vapor-L...
Pvap 58.74 kPa 362.78 Vapor-L...
Pvap 60.03 kPa 363.41 Vapor-L...
Pvap 61.37 kPa 363.94 Vapor-L...
Pvap 62.61 kPa 364.53 Vapor-L...
Pvap 64.01 kPa 365.28 Vapor-L...
Pvap 65.43 kPa 365.82 Vapor-L...
Pvap 66.70 kPa 366.39 Vapor-L...
Pvap 67.81 kPa 366.97 Vapor-L...
Pvap 69.73 kPa 367.70 Vapor-L...
Pvap 70.69 kPa 368.21 Vapor-L...
Pvap 72.02 kPa 368.77 Vapor-L...
Pvap 73.27 kPa 369.20 Vapor-L...
Pvap 74.67 kPa 369.77 Vapor-L...
Pvap 76.02 kPa 370.39 Vapor-L...
Pvap 77.77 kPa 371.01 Vapor-L...
Pvap 78.69 kPa 371.35 Vapor-L...
Pvap 79.90 kPa 371.83 Vapor-L...
Pvap 81.22 kPa 372.32 Vapor-L...
Pvap 82.86 kPa 372.98 Vapor-L...
Pvap 83.42 kPa 373.23 Vapor-L...
Pvap 85.54 kPa 374.00 Vapor-L...
Pvap 86.83 kPa 374.46 Vapor-L...
Pvap 87.98 kPa 374.80 Vapor-L...
Pvap 89.51 kPa 375.42 Vapor-L...
Pvap 90.70 kPa 375.83 Vapor-L...
Pvap 91.92 kPa 376.18 Vapor-L...
Pvap 92.98 kPa 376.53 Vapor-L...
Pvap 94.84 kPa 377.23 Vapor-L...
Pvap 95.98 kPa 377.54 Vapor-L...
Pvap 97.12 kPa 377.91 Vapor-L...
Pvap 98.83 kPa 378.53 Vapor-L...
Pvap 100.02 kPa 378.91 Vapor-L...
Pvap 101.32 kPa 379.33 Vapor-L...
Pvap 102.50 kPa 379.63 Vapor-L...
Pvap 101.32 ± 0.02 kPa 380.13 Solutio...
Pvap 101.32 ± 0.02 kPa 380.13 Isobari...
Pvap 104.07 kPa 380.17 Vapor-L...
Pvap 105.51 kPa 380.63 Vapor-L...
Pvap 106.83 kPa 381.03 Vapor-L...
Pvap 107.92 kPa 381.30 Vapor-L...
Pvap 109.24 kPa 381.70 Vapor-L...
Pvap 110.80 kPa 382.22 Vapor-L...
Pvap 112.00 kPa 382.51 Vapor-L...
Pvap 113.36 kPa 382.90 Vapor-L...
Pvap 114.60 kPa 383.32 Vapor-L...
Pvap 116.00 kPa 383.66 Vapor-L...
Pvap 117.36 kPa 384.03 Vapor-L...
Pvap 118.60 kPa 384.40 Vapor-L...
Pvap 120.01 kPa 384.83 Vapor-L...
Pvap 121.48 kPa 385.23 Vapor-L...
Pvap 122.69 kPa 385.51 Vapor-L...
Pvap 123.93 kPa 385.84 Vapor-L...
Pvap 125.48 kPa 386.31 Vapor-L...
Pvap 126.69 kPa 386.58 Vapor-L...
Pvap 128.01 kPa 386.93 Vapor-L...
Pvap 129.35 kPa 387.32 Vapor-L...
Pvap 130.79 kPa 387.69 Vapor-L...
Pvap 131.85 kPa 387.92 Vapor-L...
Pvap 133.41 kPa 388.37 Vapor-L...
Pvap 134.53 kPa 388.60 Vapor-L...
Pvap 136.15 kPa 389.06 Vapor-L...
Pvap 137.47 kPa 389.38 Vapor-L...
Pvap 138.88 kPa 389.73 Vapor-L...
Pvap 140.17 kPa 390.04 Vapor-L...
Pvap 141.21 kPa 390.26 Vapor-L...
Pvap 142.57 kPa 390.58 Vapor-L...
Pvap 143.71 kPa 390.85 Vapor-L...
Pvap 145.47 kPa 391.31 Vapor-L...
Pvap 146.81 kPa 391.62 Vapor-L...
Pvap 147.92 kPa 391.84 Vapor-L...
Pvap 149.45 kPa 392.24 Vapor-L...
Pvap 150.41 kPa 392.42 Vapor-L...
Pvap 152.16 kPa 392.86 Vapor-L...
Pvap 154.53 kPa 393.36 Vapor-L...
Pvap 156.14 kPa 393.76 Vapor-L...
Pvap 157.28 kPa 393.97 Vapor-L...
Pvap 158.68 kPa 394.32 Vapor-L...
Pvap 160.14 kPa 394.63 Vapor-L...
Pvap 161.36 kPa 394.90 Vapor-L...
Pvap 162.84 kPa 395.19 Vapor-L...
Pvap 164.08 kPa 395.48 Vapor-L...
n0 [1.37730; 1.39040]   [291.15; 318.15] Show Hide
n0 1.39040 291.15 Isobari...
n0 1.39040 ± 0.00020 291.15 Experim...
n0 1.38870 293.15 Isobari...
n0 1.38720 ± 0.00020 298.15 Experim...
n0 1.38700 298.15 Thermod...
n0 1.38720 298.15 Isobari...
n0 1.38360 303.15 Vapor-L...
n0 1.37730 318.15 Vapor-L...
n0 1.37760 318.15 Isobari...
ρl [866.77; 896.00] kg/m3 [291.15; 318.15] Show Hide
ρl 895.86 ± 0.02 kg/m3 291.15 Experim...
ρl 896.00 ± 0.02 kg/m3 291.15 Isobari...
ρl 895.73 ± 0.02 kg/m3 291.15 Solutio...
ρl 888.66 ± 0.02 kg/m3 298.15 Isobari...
ρl 888.47 ± 0.02 kg/m3 298.15 Experim...
ρl 888.17 kg/m3 298.15 Thermod...
ρl 888.33 ± 0.02 kg/m3 298.15 Solutio...
ρl 883.40 kg/m3 303.15 Vapor-L...
ρl 877.73 ± 0.02 kg/m3 308.15 Solutio...
ρl 878.24 ± 0.02 kg/m3 308.15 Isobari...
ρl 866.77 ± 0.02 kg/m3 318.15 Solutio...
ρl 867.74 kg/m3 318.15 Vapor-L...
ρl 867.21 ± 0.02 kg/m3 318.15 Isobari...

Similar Compounds

Formic acid, pentyl ester. Formic acid, hexyl ester. Acetic acid, butyl ester. butyl-d3 acetate. Formic acid, heptyl ester. Butyl glyoxylate. Formic acid, undecyl ester. Eicosanyl formate. Formic acid, octyl ester. 1-Heneicosyl formate. Dodecyl formate. Formic acid, decyl ester. Octadecyl formate. Tetradecyl formate. Hexadecyl formate.

Find more compounds similar to Formic acid, butyl ester.

Mixtures

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.