3-Acetyl-2,4-dimethylpyrrole - CAS 2386-25-6
Catalog: |
BB018211 |
Product Name: |
3-Acetyl-2,4-dimethylpyrrole |
CAS: |
2386-25-6 |
Synonyms: |
1-(2,4-dimethyl-1H-pyrrol-3-yl)ethanone |
IUPAC Name: | 1-(2,4-dimethyl-1H-pyrrol-3-yl)ethanone |
Description: | 3-Acetyl-2,4-dimethylpyrrole (CAS# 2386-25-6) is a useful research chemical, a central nervous system depressant. |
Molecular Weight: | 137.18 |
Molecular Formula: | C8H11NO |
Canonical SMILES: | CC1=CNC(=C1C(=O)C)C |
InChI: | InChI=1S/C8H11NO/c1-5-4-9-6(2)8(5)7(3)10/h4,9H,1-3H3 |
InChI Key: | VGZCKCJMYREIKA-UHFFFAOYSA-N |
Boiling Point: | 250.9 °C at 760 mmHg |
Purity: | 97 % |
Density: | 1.04 g/cm3 |
Appearance: | Brown to purple crystals or powder |
MDL: | MFCD00005221 |
LogP: | 1.83410 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110814362-A | Preparation method of nano material with carbon-coated metal particle anchoring structure | 20191119 |
CN-110833835-A | Preparation method of carbon-coated metal particle anchored nano catalytic material | 20191119 |
WO-2021100699-A1 | Black particles, black coating material, coating film, and black matrix for color filters | 20191118 |
CN-112563571-A | Additive for battery, secondary battery, battery module, battery pack and device | 20190926 |
WO-2021057306-A1 | Additive for battery, secondary battery, battery module, battery pack, and apparatus | 20190926 |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.084063974 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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Related Functional Groups
Pyrroles
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