CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Melting point = 7.7 deg C; [ChemIDplus] Liquid; [Aldrich MSDS] |
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Boiling Point | 168.00 to 171.00 °C. @ 740.00 mm Hg |
Melting Point | 7.7 °C |
Vapor Pressure | 0.8 [mmHg] |
LogP | 1.47 |
Kovats Retention Index | 898 890 898 900 900 902 |
Chemical Classes | Nitrogen Compounds -> Pyrroles |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Flame Flammables GHS02 Skull and Crossbones Acute Toxicity GHS06 |
GHS Hazard Statements |
H226:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 95.14 g/mol |
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XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 0 |
Exact Mass | 95.073499291 g/mol |
Monoisotopic Mass | 95.073499291 g/mol |
Topological Polar Surface Area | 15.8 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 53.2 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2,5-Dimethyl-1H-pyrrole is a member of pyrroles.