Chemical Properties of 1-Methyl-2-morpholin-4-ylethyl acetate

InChI

InChI=1S/C9H17NO3/c1-8(13-9(2)11)7-10-3-5-12-6-4-10/h8H,3-7H2,1-2H3

InChI Key

GHAXYOUATULXSS-UHFFFAOYSA-N

Formula

C9H17NO3

SMILES

CC(=O)OC(C)CN1CCOCC1

Molecular Weight¹

187.24

Other Names

• 4-Morpholineethanol, «alpha»-methyl-, acetate
• «alpha»-Methyl-4-morpholineethanol acetate
• 4-(2-Acetoxypropyl)morpholine
• N-(2-Acetoxypropyl)morpholine
• 1-Morpholinopropan-2-ol acetate

• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	8.61	eV	Relay (1.0) Calculated Property
logPoct/wat	0.270		Crippen Calculated Property
McVol	150.100	ml/mol	McGowan Calculated Property
Pc	2556.73	kPa	Relay (1.0-beta) Calculated Property
Inp	[1287.00; 1287.00]
Inp	1287.00		NIST
Inp	1287.00		NIST
Tboil	503.16	K	Relay (1.0) Calculated Property
Tc	680.67	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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

Find more compounds similar to 1-Methyl-2-morpholin-4-ylethyl acetate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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.
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