Chemical Properties of Butamirate Citrate (CAS 18109-81-4)

Butamirate Citrate

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InChI
InChI=1S/C18H29NO3/c1-4-17(16-10-8-7-9-11-16)18(20)22-15-14-21-13-12-19(5-2)6-3/h7-11,17H,4-6,12-15H2,1-3H3
InChI Key
DDVUMDPCZWBYRA-UHFFFAOYSA-N
Formula
C18H29NO3
SMILES
CCC(C(=O)OCCOCCN(CC)CC)c1ccccc1
Molecular Weight1
307.43
CAS
18109-81-4
Other Names
  • diethyl[2-[2-(2-phenylbutyroyloxy)ethoxy]ethyl]ammonium dihydrogen citrate
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Physical Properties

Property Value Unit Source
Δf -17.49 kJ/mol Joback Calculated Property
Δfgas -493.09 kJ/mol Joback Calculated Property
Δfus 39.89 kJ/mol Joback Calculated Property
Δvap 71.16 kJ/mol Joback Calculated Property
log10WS -2.94 Crippen Calculated Property
logPoct/wat 3.082 Crippen Calculated Property
McVol 264.010 ml/mol McGowan Calculated Property
Pc 1502.31 kPa Joback Calculated Property
Inp 2021.00 NIST
Tboil 748.63 K Joback Calculated Property
Tc 941.68 K Joback Calculated Property
Tfus 430.90 K Joback Calculated Property
Vc 0.990 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [782.81; 873.48] J/mol×K [748.63; 941.68] Show Hide
Cp,gas 782.81 J/mol×K 748.63 Joback Calculated Property
Cp,gas 800.50 J/mol×K 780.81 Joback Calculated Property
Cp,gas 817.13 J/mol×K 812.98 Joback Calculated Property
Cp,gas 832.71 J/mol×K 845.16 Joback Calculated Property
Cp,gas 847.27 J/mol×K 877.33 Joback Calculated Property
Cp,gas 860.85 J/mol×K 909.51 Joback Calculated Property
Cp,gas 873.48 J/mol×K 941.68 Joback Calculated Property

Similar Compounds

Butetamate. Oxeladin. Phenbutrazate. Carbetapentane. Benzeneacetic acid, «alpha»-ethyl-, ethyl ester. Atropine, picolinyloxydimethylsilyl ether. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. Nadolol tri-TMS derivative. Scopolamine. Aposcopolamine. Methylscopolamine. 6,7-Dehydrohyoscyamine. Mandelic acid, «alpha»-cyclopentyl-, 1-methyl-4-piperidyl ester. Tropate, TMS. Benzeneacetic acid, «alpha»-[[(trimethylsilyl)oxy]methyl]-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.0(2,4)]non-7-yl ester, [7(S)-(1«alpha»,2«beta»,4«beta»,5«alpha»,7«beta»)]-.

Find more compounds similar to Butamirate Citrate.

Sources

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