Chemical Properties of 3-Indoleacrylic acid, methyl ester

3-Indoleacrylic acid, methyl ester

InChI
InChI=1S/C12H11NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-8,13H,1H3/b7-6+
InChI Key
JKVXFZPEUCTHQO-VOTSOKGWSA-N
Formula
C12H11NO2
SMILES
COC(=O)C=Cc1c[nH]c2ccccc12
Molecular Weight1
201.22
Other Names
  • Methyl (2E)-3-(1H-indol-3-yl)acrylate
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Physical Properties

Property Value Unit Source
logPoct/wat 1.872 Crippen Calculated Property
McVol 154.140 ml/mol McGowan Calculated Property
Inp [2230.00; 2231.50]   Show Hide
Inp 2230.00 NIST
Inp 2231.50 NIST
Inp 2230.00 NIST
Tboil 604.91 K Relay (1.0) Calculated Property
Tfus 408.84 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Ethyl indole-3-acrylate. 2-Propenoic acid, 3-[1-(trimethylsilyl)-1H-indol-3-yl]-, trimethylsilyl ester. 3-Indoleacrylic acid, N-(tert-butyldimethylsilyl)-, (tert-butyldimethylsilyl) ester. Tropanyl indole-3-lactate. Tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 5-Hydroxytryptophan, ethoxycarbonylated, TBDMS # 1. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 10-Methoxy-14-methyl-5-oxo-5,7,8,14-tetrahydro-indolo-[2,3-c]-quinazo-[3,2,a]-pyridine. Dimetindene M (nor, OH), acetylated. amikacin. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Valine-glutamine-tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. N6-TMS-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. N6-TMS-2'-Deoxyadenosine, 3'-O-TMS, 5'-O-TBDMS. Betamethasone tetra-TMS.

Find more compounds similar to 3-Indoleacrylic acid, methyl ester.

Sources

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