Chemical Properties of 1-Pentyn-3-ol, 3-methyl- (CAS 77-75-8)

1-Pentyn-3-ol, 3-methyl-

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InChI
InChI=1S/C6H10O/c1-4-6(3,7)5-2/h1,7H,5H2,2-3H3
InChI Key
QXLPXWSKPNOQLE-UHFFFAOYSA-N
Formula
C6H10O
SMILES
C#CC(C)(O)CC
Molecular Weight1
98.14
CAS
77-75-8
Other Names
  • (+/-)-3-Methylpent-1-yn-3-ol
  • 2-Butanol, 2-ethynyl-
  • 2-Ethinyl butanol-2
  • 2-Ethynyl-2-butanol
  • 3-Hydroxy-3-methyl-1-pentyne
  • 3-Methyl-1-pentin-3-ol
  • 3-Methyl-1-pentyn-3-ol
  • 3-Methyl-1-pentyne-3-ol
  • 3-Methyl-pentin-(1)-ol-(3)
  • 3-Methylpent-1-yn-3-ol
  • 3-Methylpentin-3-ol
  • 3-Methylpentyn-3-ol
  • 3-Metil-pentin-3-ol
  • Allotropal
  • Aniphor
  • Apridol
  • Atemorin
  • Atempol
  • BDH
  • Citodorm
  • Comesa
  • Dalgol
  • Dorison
  • Dormalest
  • Dormidin
  • Dormigen
  • Dormiphen
  • Dormison
  • Dormocit
  • Dormosan
  • Ethinylmethylethylcarbinol
  • Ethyl ethynyl methyl carbinol
  • Ethynylethylmethylcarbinol
  • Formison
  • Hesofen
  • Hexofen
  • Imnudorm
  • Insomnol
  • Macarol
  • Mecarol
  • Melpintol
  • Meparfynol
  • Mepentamato
  • Mepentil
  • Methylethylacetylenylcarbinol
  • Methylethylethynylcarbinol
  • Methylparafynol
  • Methylpentinol
  • Methylpentynol
  • Methylpentynolum
  • Metilparafinolo
  • Metilpentinolo
  • Miramel
  • N-Oblivon
  • Noxokratin
  • Oblevil
  • Oblivon
  • Oblivon C
  • Olfine P
  • Olosot
  • Olvadon
  • Pent-1-yne-3-ol, 3-methyl-
  • Pentadorm
  • Pentinol
  • Pentydorm
  • Pentydrom
  • Pentyrest
  • Perlopal
  • Placidal
  • Riposon
  • Sedapercut
  • Seral
  • Sintyal
  • Somnesin
  • Sonnormon
  • Trusono
  • Util
  • anti-Stress
  • «alpha»-Ethyl-«alpha»-methylpropargyl alcohol
  • «alpha»-Ethyl-«alpha»-methylpropargyl alcohol
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Physical Properties

Property Value Unit Source
Δf 88.73 kJ/mol Joback Calculated Property
Δfgas -36.25 kJ/mol Joback Calculated Property
Δfus 10.94 kJ/mol Joback Calculated Property
Δvap 44.19 kJ/mol Joback Calculated Property
IE 10.03 eV NIST
log10WS -1.50 Crippen Calculated Property
logPoct/wat 0.781 Crippen Calculated Property
McVol 92.670 ml/mol McGowan Calculated Property
Pc 4244.08 kPa Joback Calculated Property
Inp [660.00; 715.00]   Show Hide
Inp 690.00 NIST
Inp 660.00 NIST
Inp 663.00 NIST
Inp 695.00 NIST
Inp 695.00 NIST
Inp 715.00 NIST
Inp 715.00 NIST
Inp 695.00 NIST
I 1275.00 NIST
Tboil [393.70; 394.50] K Show Hide
Tboil 394.50 ± 0.50 K NIST
Tboil 393.70 K NIST
Tc 598.74 K Joback Calculated Property
Tfus 267.59 K Joback Calculated Property
Vc 0.342 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [182.97; 229.97] J/mol×K [415.75; 598.74] Show Hide
Cp,gas 182.97 J/mol×K 415.75 Joback Calculated Property
Cp,gas 192.04 J/mol×K 446.25 Joback Calculated Property
Cp,gas 200.58 J/mol×K 476.75 Joback Calculated Property
Cp,gas 208.62 J/mol×K 507.24 Joback Calculated Property
Cp,gas 216.18 J/mol×K 537.74 Joback Calculated Property
Cp,gas 223.28 J/mol×K 568.24 Joback Calculated Property
Cp,gas 229.97 J/mol×K 598.74 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.30; 204.68] kPa [302.15; 416.15] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.64833e+01
Coefficient B-4.07773e+03
Coefficient C-5.08210e+01
Temperature range, min.302.15
Temperature range, max.416.15
Pvap 1.30 kPa 302.15 Calculated Property
Pvap 2.82 kPa 314.82 Calculated Property
Pvap 5.72 kPa 327.48 Calculated Property
Pvap 10.91 kPa 340.15 Calculated Property
Pvap 19.70 kPa 352.82 Calculated Property
Pvap 33.93 kPa 365.48 Calculated Property
Pvap 56.02 kPa 378.15 Calculated Property
Pvap 89.10 kPa 390.82 Calculated Property
Pvap 137.08 kPa 403.48 Calculated Property
Pvap 204.68 kPa 416.15 Calculated Property

Similar Compounds

1-Pentyn-3-ol, 3-ethyl-. 3-Methyl-4-hexyn-3-ol. 4,6-Decadiyne-3,8-diol, 3,8-dimethyl-. 3,6-Dimethyl-4-octyn-3,6-diol. 1-Hexyn-3-ol, 3-methyl-. 1-Pentyn-3-ol, 3,4-dimethyl-. Amylene hydrate. 3,6-Dimethyl-6-hepten-4-yn-3-ol. 3-Methylnon-1-yn-3-ol. 4-Methyl-2-heptyn-4-ol. 1-Hexyn-3-ol, 3,5-dimethyl-. 3,6-Dimethyl-1-heptyn-3-ol. 3-Pentanol, 3-methyl-. 1-Hexadecyn-3-ol, 3,7,11,15-tetramethyl-. 1-Dodecyn-3-ol, 3,7,11-trimethyl-.

Find more compounds similar to 1-Pentyn-3-ol, 3-methyl-.

Sources

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