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Cas Database |
| Name |
N-Methylpyrrole-2-carboxaldehyde |
EINECS | 214-755-0 |
| CAS No. | 1192-58-1 | Density | 1.01 g/cm3 |
| PSA | 22.00000 | LogP | 0.83760 |
| Solubility | N/A | Melting Point |
58oC |
| Formula | C6H7NO | Boiling Point | 195.5 °C at 760 mmHg |
| Molecular Weight | 109.128 | Flash Point | 72.2 °C |
| Transport Information | N/A | Appearance | Clear colourless to slightly pink liquid |
| Safety | 26-36 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
Pyrrole-2-carboxaldehyde,1-methyl- (6CI,7CI,8CI);1-Methyl-1H-pyrrole-2-carboxaldehyde;1-Methyl-2-formylpyrrole;1-Methylpyrrole-2-carboxaldehyde;2-Formyl-1-methylpyrrole;2-Formyl-N-methylpyrrole;N-Methyl-2-formylpyrrole;N-Methyl-2-pyrrolaldehyde;N-Methyl-2-pyrrolylcarboxaldehyde;N-Methylpyrrole-2-carbaldehyde;NSC 72386; |
Article Data | 59 |
N-Methylpyrrole-2-carboxaldehyde Chemical Properties
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IUPAC Name: 1-Methylpyrrole-2-carbaldehyde
Empirical Formula: C6H7NO
Molecular Weight: 109.1259
Canonical SMILES: CN1C=CC=C1C=O
InChI: InChI=1S/C6H7NO/c1-7-4-2-3-6(7)5-8/h2-5H,1H3
InChIKey: OUKQTRFCDKSEPL-UHFFFAOYSA-N
XLogP3-AA: 0.5
H-Bond Donor: 0
H-Bond Acceptor: 1
EINECS: 214-755-0
Product Categories: Building Blocks; Heterocyclic Building Blocks; Pyrroles
storage temp.: 2-8 °C
Index of Refraction: 1.512
Molar Refractivity: 32.26 cm3
Molar Volume: 107.4 cm3
Surface Tension: 36.1 dyne/cm
Density: 1.01 g/cm3
Flash Point: 72.2 °C
Enthalpy of Vaporization: 43.17 kJ/mol
Boiling Point: 195.5 °C at 760 mmHg
Vapour Pressure: 0.418 mmHg at 25 °C
Sensitive of 1H-Pyrrole-2-carboxaldehyde,1-methyl- (CAS NO.1192-58-1): Air Sensitive
N-Methylpyrrole-2-carboxaldehyde Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02362, |
N-Methylpyrrole-2-carboxaldehyde Safety Profile
Hazard Codes: 
Xi
Risk Statements 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
RTECS of 1H-Pyrrole-2-carboxaldehyde,1-methyl- (CAS NO.1192-58-1): UX9350000
N-Methylpyrrole-2-carboxaldehyde Specification
1H-Pyrrole-2-carboxaldehyde,1-methyl- (CAS NO.1192-58-1), its Synonyms are 1-Methyl-1H-pyrrole-2-carboxaldehyde ; 1-Methylpyrrole-2-carbaldehyde ; 2-Formyl-1-methylpyrrole . It is clear colourless to slightlypink liquid.
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