Basic information
- CAS
20120-26-7- Standard SMILES
COC(=O)C(C)CN1CCOCC1- InChIKey
KGDDIHUWJWGQDG-UHFFFAOYSA-N- Molecular formula
- C9H17NO3
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.1208434
Names & identifiers
- Preferred name
- 4-Morpholinepropanoic acid, alpha-methyl-, methyl ester
- IUPAC
- methyl 2-methyl-3-morpholin-4-ylpropanoate
- English name
- methyl alpha-methyl-4-morpholinepropionate
- Molecular formula
- C9H17NO3
- Molecular weight
- 187.24
Names & synonyms
EINECS 243-527-34-Morpholinepropanoic acid, alpha-methyl-, methyl ester4-Morpholinepropanoic acid, .alpha.-methyl-, methyl esterRefChem:52578320120-26-7Methyl 2-methyl-3-morpholinopropanoatemethyl 2-methyl-3-(morpholin-4-yl)propanoateMethyl alpha-methyl-4-morpholinepropionatemethyl 2-methyl-3-morpholin-4-ylpropanoateSCHEMBL1816291SCHEMBL1816293DTXSID50893282
Show more names
Methyl α-Methyl-4-morpholinepropionateα-Methyl-4-morpholinepropanoic acid methyl ester3-Morpholino-2-methylpropanoic acid methyl ester2-Methyl-3-morpholinopropionic acid methyl ester2-Methyl-3-morpholinopropanoic acid methyl ester4-Morpholinepropanoic acid, α-methyl-, methyl ester
KGDDIHUWJWGQDG-UHFFFAOYSA-NMethyl 2-morpholinomethylpropanoateALBB-033224MFCD00134816Methyl2-methyl-3-morpholinopropanoateAKOS008963301methyl 2-methyl-3-morpholino-propanoateLS-12550
Database identifiers
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Boiling point
- 112 °C · 112 °C(Press: 13 Torr)
- Density
- 1.043 · 1.043±0.06 g/cm3(Predicted)
- solubility
- soluble in Diethyl Ether
- form
- Liquid
- pka
- 6.62 · 6.62±0.10(Predicted)
- color
- Colorless
- EPA Substance Registry System
- 4 · 4-Morpholinepropanoic acid, .alpha.-methyl-, methyl ester (20120-26-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4-Morpholinepropanoic acid, .alpha.-methyl-, methyl ester: ACTIVE
Applications
UsesMethyl α-Methyl-4-morpholinepropionate is an intermediate in synthesizing (S)-Moramide D-Tartrate (M630190), which is a controlled substance (opiate). Analgesic (narcotic).
Suppliers5 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
常州琬瑶生物科技有限公司051989185693 15312551983 · [email protected]
上海拓朴医药科技有限公司+86 (21) 5196-9732
苏州岚云医药科技有限公司2332782371 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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