-
Name
Methyl 1-methyl-2-pyrroleacetate
- EINECS 257-478-0
- CAS No. 51856-79-2
- Article Data11
- CAS DataBase
- Density 1.05 g/cm3
- Solubility 8.3 g/L (20 °C ) in water
- Melting Point ≥210ºC
- Formula C8H11NO2
- Boiling Point 242 °C at 760 mmHg
- Molecular Weight 153.181
- Flash Point 88.8 °C
- Transport Information
- Appearance Clear orange to slightly brown liquid
- Safety 26-37/39
- Risk Codes 36/37/38-22
-
Molecular Structure
-
Hazard Symbols
Xn
- Synonyms 1-Methyl-2-pyrroleaceticacid methyl ester;Methyl (1-methyl-1H-pyrrol-2-yl)acetate;Methyl(1-methylpyrrol-2-yl)acetate;Methyl 1-methyl-1H-pyrrole-2-acetate;Methyl1-methylpyrrole-2-acetate;Methyl 2-(1-methylpyrrol-2-yl)acetate;MethylN-methyl-2-pyrrolylacetate;
- PSA 31.23000
- LogP 0.74060
Methyl 1-methyl-2-pyrroleacetate Chemical Properties
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IUPAC Name: Methyl 2-(1-methylpyrrol-2-yl)acetate
Empirical Formula: C8H11NO2
Molecular Weight: 153.1784
Canonical SMILES: CN1C=CC=C1CC(=O)OC
InChI: InChI=1S/C8H11NO2/c1-9-5-3-4-7(9)6-8(10)11-2/h3-5H,6H2,1-2H3
InChIKey: CGYVDYLHQYNGFC-UHFFFAOYSA-N
XLogP3-AA: 0.5
H-Bond Donor: 0
H-Bond Acceptor: 2
Index of Refraction: 1.498
Molar Refractivity: 42.68 cm3
Molar Volume: 145.5 cm3
Surface Tension: 34.3 dyne/cm
Density: 1.05 g/cm3
Flash Point: 88.8 °C
Enthalpy of Vaporization: 47.9 kJ/mol
Boiling Point: 242 °C at 760 mmHg
Vapour Pressure: 0.0348 mmHg at 25 °C
Water Solubility of 1H-Pyrrole-2-aceticacid, 1-methyl-, methyl ester (CAS NO.51856-79-2): 8.3 g/L (20 ºC)
Methyl 1-methyl-2-pyrroleacetate Safety Profile
Hazard Codes: 
Xi,
Xn
Risk Statements: 36/37/38-22
R36/37/38:Irritating to eyes, respiratory system and skin.
R22:Harmful if swallowed.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany of 1H-Pyrrole-2-aceticacid, 1-methyl-, methyl ester (CAS NO.51856-79-2): 3
Methyl 1-methyl-2-pyrroleacetate Specification
1H-Pyrrole-2-aceticacid, 1-methyl-, methyl ester (CAS NO.51856-79-2), its Synonyms are Methyl 1-methylpyrrol-2-acetate ; Methyl (1-methyl-1H-pyrrol-2-yl)acetate ; Methyl 1-methyl-1H-pyrrole-2-acetate ; Methyl(1-methyl-2-pyrrolyl)acetate . It is clear orange to slightly brown liquid.
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