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Molecule
Lactamide Mea
CAS: 5422-34-4 · C5H11NO3
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 5422-34-4
- Molecular Formula
- C5H11NO3
- Molecular Mass
- 133.15 g/mol
Identifiers
CAS Registry Number
5422-34-4
SMILES
CC(O)C(O)=NCCO
InChI Key
RZCHTMXTKQHYDT-UHFFFAOYSA-N
InChI
InChI=1S/C5H11NO3/c1-4(8)5(9)6-2-3-7/h4,7-8H,2-3H2,1H3,(H,6,9)
Names and Synonyms
- Lactamide Mea Common Name
- N-(2-Hydroxyethyl)lactamide Synonym
- Propanamide, 2-hydroxy-N-(2-hydroxyethyl)-, (±)- Synonym
- Propanamide, 2-hydroxy-N-(2-hydroxyethyl)- Synonym
- Lactamide, N-(2-hydroxyethyl)- Synonym
- 2-Hydroxy-N-(2-hydroxyethyl)propanamide Synonym
- N-(β-Hydroxyethyl)-2-hydroxypropionamide Synonym
- N-(β-Hydroxyethyl)lactamide Synonym
- Incromectant LMEA Synonym
- Lactamide MEA Synonym
- NSC 11062 Synonym
- Lactic acid monoethanolamide Synonym
- Lipamide LMEA Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 133.15 g/mol | CAS Common Chemistry |
| 133.14700000000002 g/mol | RDKit | |
| 133.147 g/mol | RDKit | |
| Density | 1.19 g/cm³ | CAS Common Chemistry |
| 1.1860 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O=C(NCCO)C(O)C | CAS Common Chemistry |
| InChI | InChI=1S/C5H11NO3/c1-4(8)5(9)6-2-3-7/h4,7-8H,2-3H2,1H3,(H,6,9) | CAS Common Chemistry |
| InChI Key | InChIKey=RZCHTMXTKQHYDT-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Lactamide MEA | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 73.05 Ų | RDKit |
| LogP | -0.6840000000000002 | RDKit |
| -0.684 | RDKit | |
| Molar Refractivity | 33.697399999999995 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8 | RDKit |
| Exact Mass | 133.073893212 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 133.15 g/mol; density = 1.190 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C5H11NO3.
