2,4-Dibromo-3-pentanone - CAS 815-60-1
Catalog: |
BB036671 |
Product Name: |
2,4-Dibromo-3-pentanone |
CAS: |
815-60-1 |
Synonyms: |
2,4-dibromopentan-3-one |
IUPAC Name: | 2,4-dibromopentan-3-one |
Description: | 2,4-Dibromo-3-pentanone (CAS# 815-60-1 ) is a useful research chemical. |
Molecular Weight: | 243.92 |
Molecular Formula: | C5H8Br2O |
Canonical SMILES: | CC(C(=O)C(C)Br)Br |
InChI: | InChI=1S/C5H8Br2O/c1-3(6)5(8)4(2)7/h3-4H,1-2H3 |
InChI Key: | UOPIOAUZQKSZRO-UHFFFAOYSA-N |
Boiling Point: | 67-82 °C / 10 mmHg |
Density: | 1.802 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD00015719 |
LogP: | 2.12230 |
GHS Hazard Statement: | H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P304+P340, P305+P351+P338, P312, P330, P337+P313, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113512037-A | Pyridopyrazinone ionic compound and preparation method and application thereof | 20210322 |
WO-2019162806-A1 | Polymeric materials formed using initiators with a ketone group and two thiocarbonylthio-containing groups | 20180221 |
CN-111757895-A | Polymeric materials formed using initiators having a ketone group and two thiocarbonylthio groups | 20180221 |
EP-3755728-A1 | Polymeric materials formed using initiators with a ketone group and two thiocarbonylthio-containing groups | 20180221 |
US-2021101867-A1 | Polymeric materials formed using initiators with a ketone group and two thiocarbonylthio-containing groups | 20180221 |
PMID | Publication Date | Title | Journal |
22998507 | 20121010 | Experimental verification of the homoaromaticity of 1,3,5-cycloheptatriene and evaluation of the aromaticity of tropone and the tropylium cation by use of the dimethyldihydropyrene probe | Journal of the American Chemical Society |
19127245 | 20090101 | Synthesis and phytogrowth properties of oxabicyclic analogues related to helminthosporin | Molecules (Basel, Switzerland) |
18808140 | 20081022 | Synthesis and phytotoxic activity of ozonides | Journal of agricultural and food chemistry |
12662078 | 20030404 | Scope and limitations of the double [4+3]-cycloadditions of 2-oxyallyl cations to 2,2'-methylenedifuran and derivatives | The Journal of organic chemistry |
Complexity: | 82.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.89214 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.89419 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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