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CAS No.: | 34402-78-3 |
---|---|
Name: | METHYL 4-METHYL-1H-PYRROLE-2-CARBOXYLATE |
Article Data: | 15 |
Molecular Structure: | |
Formula: | C7H9NO2 |
Molecular Weight: | 139.154 |
Synonyms: | Pyrrole-2-carboxylicacid, 4-methyl-, methyl ester (7CI,8CI);4-Methyl-1H-pyrrole-2-carboxylic acidmethyl ester;Methyl 4-methylpyrrole-2-carboxylate; |
Density: | 1.141g/cm3 |
Melting Point: | 73-74℃ (cyclohexane ) |
Boiling Point: | 250.2°Cat760mmHg |
Flash Point: | 105.1°C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 42.09000 |
LogP: | 1.10970 |
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Molecular Structure of 1H-Pyrrole-2-carboxylicacid, 4-methyl-, methyl ester (CAS No.34402-78-3):
Molecular Formula: C7H9NO2
Molecular Weight: 139.1519
IUPAC Name: Methyl 4-methyl-1H-pyrrole-2-carboxylate
CAS No: 34402-78-3
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 42.09 Å2
Index of Refraction: 1.524
Molar Refractivity: 37.284 cm3
Molar Volume: 121.924 cm3
Surface Tension: 41.455 dyne/cm
Density: 1.141 g/cm3
Flash Point: 105.102 °C
Enthalpy of Vaporization: 48.743 kJ/mol
Boiling Point: 250.174 °C at 760 mmHg
Vapour Pressure: 0.022 mmHg at 25°C
Canonical SMILES: CC1=CNC(=C1)C(=O)OC
InChI: InChI=1S/C7H9NO2/c1-5-3-6(8-4-5)7(9)10-2/h3-4,8H,1-2H3
InChIKey: BMCUQYLZVGVDCW-UHFFFAOYSA-N
Product Categories: Esters;Pyrroles Indoles;Pyrroles Indoles
1H-Pyrrole-2-carboxylicacid, 4-methyl-, methyl ester (CAS No.34402-78-3), it also can be called Methyl 4-methyl-1H-pyrrole-2-carboxylate ; Methyl 4-methylpyrrole-2-carboxylate .