2-(morpholin-4-yl)ethyl 2-methylprop-2-enoate

• ChemBase ID: 143271
• Molecular Formular: C10H17NO3
• Molecular Mass: 199.24688
• Monoisotopic Mass: 199.12084341
• SMILES: CC(=C)C(=O)OCCN1CCOCC1
• Canonical SMILES: CC(=C)C(=O)OCCN1CCOCC1
• InChI: InChI=1S/C10H17NO3/c1-9(2)10(12)14-8-5-11-3-6-13-7-4-11/h1,3-8H2,2H3
• InChIKey: MNZNJOQNLFEAKG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(morpholin-4-yl)ethyl 2-methylprop-2-enoate
• IUPAC Traditional name: 2-(morpholin-4-yl)ethyl 2-methylprop-2-enoate
• Synonyms: MEMA; 2-Methylprop-2-enoate; 2-Morpholin-4-ylethyl; 2-N-Morpholinoethyl methacrylate; 2-吗啉-4-基乙基; 甲基丙烯酸[2-(4-吗啉基)乙基]酯; 2-甲基-2-丙烯酸2-(4-吗啉基)乙基酯

Database IDs

• CAS Number: 2997-88-8
• MDL Number: MFCD00080577
• PubChem SID: 162237492
• PubChem CID: 76343

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.36656204
• LogD (pH = 7.4): 1.0838426
• Log P: 1.1078693
• Molar Refractivity: 53.5112 cm^3
• Polarizability: 21.175404 Å^3
• Polar Surface Area: 38.77 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: liquid
• Flash Point: >110 °C; >230 °F

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H319
• GHS Precautionary statements: P305 + P351 + P338

Product Information

• Purity: 95%
• Contains: MEHQ as inhibitor
• Empirical Formula (Hill Notation): C10H17NO3

DETAILS

Sigma Aldrich - 729833

Packaging
25 g in glass bottle