Chemical Properties of Butanoic acid, 3-hydroxy-, methyl ester, (S)- (CAS 53562-86-0)

Butanoic acid, 3-hydroxy-, methyl ester, (S)-

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InChI
InChI=1S/C5H10O3/c1-4(6)3-5(7)8-2/h4,6H,3H2,1-2H3/t4-/m1/s1
InChI Key
LDLDJEAVRNAEBW-SCSAIBSYSA-N
Formula
C5H10O3
SMILES
COC(=O)CC(C)O
Molecular Weight1
118.13
CAS
53562-86-0
Other Names
  • Methyl (S)-(+)-3-hydroxybutyrate
  • Butanoic acid, 3-hydroxy-, methyl ester, (3S)-
  • (+)-(3S)-3-Hydroxybutanoic acid methyl ester
  • (S)-3-Hydroxybutanoic acid methyl ester
  • (S)-Methyl 3-hydroxybutanoate
  • (.+/-.)-3-Hydroxybutyric acid, methyl ester
  • methyl (S)-3-hydroxybutyrate
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Physical Properties

Property Value Unit Source
Δf -381.96 kJ/mol Joback Calculated Property
Δfgas -548.84 kJ/mol Joback Calculated Property
Δfus 12.06 kJ/mol Joback Calculated Property
Δvap 52.17 kJ/mol Joback Calculated Property
log10WS -0.15 Crippen Calculated Property
logPoct/wat -0.070 Crippen Calculated Property
McVol 94.620 ml/mol McGowan Calculated Property
Pc 4151.61 kPa Joback Calculated Property
Tboil 481.83 K Joback Calculated Property
Tc 657.66 K Joback Calculated Property
Tfus 264.09 K Joback Calculated Property
Vc 0.352 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [204.80; 248.43] J/mol×K [481.83; 657.66] Show Hide
Cp,gas 204.80 J/mol×K 481.83 Joback Calculated Property
Cp,gas 212.77 J/mol×K 511.13 Joback Calculated Property
Cp,gas 220.46 J/mol×K 540.44 Joback Calculated Property
Cp,gas 227.87 J/mol×K 569.74 Joback Calculated Property
Cp,gas 235.00 J/mol×K 599.05 Joback Calculated Property
Cp,gas 241.86 J/mol×K 628.35 Joback Calculated Property
Cp,gas 248.43 J/mol×K 657.66 Joback Calculated Property
η [0.0001769; 0.0255824] Pa×s [264.09; 481.83] Show Hide
η 0.0255824 Pa×s 264.09 Joback Calculated Property
η 0.0067671 Pa×s 300.38 Joback Calculated Property
η 0.0023843 Pa×s 336.67 Joback Calculated Property
η 0.0010292 Pa×s 372.96 Joback Calculated Property
η 0.0005156 Pa×s 409.25 Joback Calculated Property
η 0.0002891 Pa×s 445.54 Joback Calculated Property
η 0.0001769 Pa×s 481.83 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 336.20 K 1.30 NIST

Similar Compounds

Butanoic acid, 3-hydroxy-, methyl ester. Butanoic acid, 3-hydroxy-, ethyl ester. Pentanedioic acid, 3-hydroxy-, dimethyl ester. Propyl butanoate, 3-hydroxy. isobutyl 3-hydroxybutanoate. Pentanoic acid, 3-hydroxy-, methyl ester. Butanoic acid, 3-hydroxy-, butyl ester. Butanoic acid, 3-hydroxy-. Diethyl 3-hydroxyglutarate. (R)-3-Hydroxybutyric acid, methyl ether, methyl ester. Hexanoic acid, 3-hydroxy-, methyl ester. Pentanoic acid, 3-hydroxy-, ethyl ester. Butanoic acid, 3-hydroxy-3-methyl-, methyl ester. hexyl 3-hydroxybutanoate. 2(3H)-Furanone, dihydro-4-hydroxy-.

Find more compounds similar to Butanoic acid, 3-hydroxy-, methyl ester, (S)-.

Sources

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