Chemical Properties of Halothane (CAS 151-67-7)

Halothane

PDF Excel Molecule Calculator
InChI
InChI=1S/C2HBrClF3/c3-1(4)2(5,6)7/h1H
InChI Key
BCQZXOMGPXTTIC-UHFFFAOYSA-N
Formula
C2HBrClF3
SMILES
FC(F)(F)C(Cl)Br
Molecular Weight1
197.38
CAS
151-67-7
Other Names
  • (.+/-.))-Halothane
  • 1,1,1-Trifluoro-2-bromo-2-chloroethane
  • 1,1,1-Trifluoro-2-chloro-2-bromoethane
  • 1-Bromo-1-chloro-2,2,2-trifluoroethane
  • 2,2,2-Trifluoro-1-chloro-1-bromoethane
  • 2-Bromo-2-chloro-1,1,1-trifluoroethane
  • Alotano
  • Anestan
  • Bromochlorotrifluoroethane
  • CF3CHClBr
  • Chalothane
  • Ethane, 1-bromo-1-chloro-2,2,2-trifluoro-
  • Ethane, 2-bromo-2-chloro-1,1,1-trifluoro-
  • FREON 123B1
  • Fluktan
  • Fluorotane
  • Fluorothane
  • Fluothane
  • Ftorotan
  • Ftuorotan
  • Halan
  • Halotan
  • Halotano
  • Halothan
  • Halsan
  • NSC 143490
  • Narcotan
  • Narcotane
  • Narcotann ne-spofa
  • Narkotan
  • Rhodialothan
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δcliquid -761.60 ± 3.20 kJ/mol NIST
Δf -615.68 kJ/mol Joback Calculated Property
Δfgas -699.90 ± 3.80 kJ/mol NIST
Δfliquid -720.00 ± 4.90 kJ/mol NIST
Δfus 8.72 kJ/mol Joback Calculated Property
Δvap [29.56; 29.80] kJ/mol Show Hide
Δvap 29.80 kJ/mol NIST
Δvap 29.80 ± 0.40 kJ/mol NIST
Δvap 29.56 ± 0.33 kJ/mol NIST
Δvap 29.60 ± 0.30 kJ/mol NIST
Δvap 29.60 ± 0.10 kJ/mol NIST
IE [11.00; 11.20] eV Show Hide
IE 11.00 eV NIST
IE 11.20 eV NIST
log10WS [-1.71; -1.53]   Show Hide
log10WS -1.53 Aq. Sol...
log10WS -1.71 Estimat...
logPoct/wat 2.509 Crippen Calculated Property
McVol 74.090 ml/mol McGowan Calculated Property
Pc 4528.58 kPa Joback Calculated Property
Inp [533.00; 555.00]   Show Hide
Inp 541.00 NIST
Inp 543.00 NIST
Inp 543.00 NIST
Inp 533.00 NIST
Inp 555.00 NIST
Inp 533.00 NIST
Inp 543.00 NIST
I 858.00 NIST
Tboil [323.00; 596.40] K Show Hide
Tboil 323.40 K NIST
Tboil 596.40 ± 0.40 K NIST
Tboil 323.00 K NIST
Tboil 323.30 K NIST
Tboil 323.42 ± 0.01 K NIST
Tc 496.30 K NIST
Tfus 157.40 ± 0.20 K NIST
Vc 0.295 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [112.10; 137.51] J/mol×K [342.89; 523.53] Show Hide
Cp,gas 112.10 J/mol×K 342.89 Joback Calculated Property
Cp,gas 117.35 J/mol×K 373.00 Joback Calculated Property
Cp,gas 122.16 J/mol×K 403.10 Joback Calculated Property
Cp,gas 126.55 J/mol×K 433.21 Joback Calculated Property
Cp,gas 130.56 J/mol×K 463.31 Joback Calculated Property
Cp,gas 134.21 J/mol×K 493.42 Joback Calculated Property
Cp,gas 137.51 J/mol×K 523.53 Joback Calculated Property
Cp,liquid 156.60 J/mol×K 298.15 NIST
ΔfusH [4.84; 4.84] kJ/mol [154.70; 157.40] Show Hide
ΔfusH 4.84 kJ/mol 154.70 NIST
ΔfusH 4.84 kJ/mol 154.70 NIST
ΔfusH 4.84 kJ/mol 157.40 NIST
ΔvapH [26.80; 34.30] kJ/mol [272.50; 343.00] Show Hide
ΔvapH 34.30 kJ/mol 272.50 NIST
ΔvapH 33.20 kJ/mol 275.50 NIST
ΔvapH 30.00 kJ/mol 310.50 NIST
ΔvapH 28.70 ± 0.10 kJ/mol 313.00 NIST
ΔvapH 28.08 kJ/mol 323.30 NIST
ΔvapH 27.80 ± 0.10 kJ/mol 328.00 NIST
ΔvapH 26.80 ± 0.10 kJ/mol 343.00 NIST
ΔfusS 30.70 J/mol×K 157.40 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [0.49; 202.67] kPa [223.15; 346.52] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.30696e+01
Coefficient B-2.19144e+03
Coefficient C-6.40470e+01
Temperature range, min.223.15
Temperature range, max.346.52
Pvap 0.49 kPa 223.15 Calculated Property
Pvap 1.47 kPa 236.86 Calculated Property
Pvap 3.75 kPa 250.57 Calculated Property
Pvap 8.37 kPa 264.27 Calculated Property
Pvap 16.88 kPa 277.98 Calculated Property
Pvap 31.28 kPa 291.69 Calculated Property
Pvap 54.04 kPa 305.40 Calculated Property
Pvap 88.03 kPa 319.10 Calculated Property
Pvap 136.44 kPa 332.81 Calculated Property
Pvap 202.67 kPa 346.52 Calculated Property
Pvap [0.46; 118.43] kPa [222.00; 328.00] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.11666e+02
Coefficient B-7.03230e+03
Coefficient C-1.51373e+01
Coefficient D2.08113e-05
Temperature range, min.222.00
Temperature range, max.328.00
Pvap 0.46 kPa 222.00 Calculated Property
Pvap 1.17 kPa 233.78 Calculated Property
Pvap 2.65 kPa 245.56 Calculated Property
Pvap 5.47 kPa 257.33 Calculated Property
Pvap 10.45 kPa 269.11 Calculated Property
Pvap 18.70 kPa 280.89 Calculated Property
Pvap 31.65 kPa 292.67 Calculated Property
Pvap 51.09 kPa 304.44 Calculated Property
Pvap 79.16 kPa 316.22 Calculated Property
Pvap 118.43 kPa 328.00 Calculated Property

Similar Compounds

Ethane, 1,1-dibromo-1-chloro-2,2,2-trifluoro-. Ethane, 2,2-dichloro-1,1,1-trifluoro-. Ethane, 2-chloro-1,1,1-trifluoro-. 2-Bromo-1,1,1-trifluoroethane. Ethane, 2-chloro-1,1,1,2-tetrafluoro-. Acetonitrile, bromochloro-. 1-Bromo-2-chloro-1,1,2-trifluoroethane. 1,2-Dibromo-1-chloro-1,2,2-trifluoroethane. 1-Chloro-2,2-difluoroethane. 2-Chloro-1,1-difluoroethane. Ethane, 1,2-dibromo-1,1-difluoro-. Ethane, 1,2-dichloro-1,1-difluoro-. 1,2-Dibromo-1,1,2-trifluoroethane. Ethane, 1,2,2-trichloro-1,1-difluoro-. Ethane, 2-bromo-1,1-difluoro-.

Find more compounds similar to Halothane.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.