1,2-Cyclopentanedione - CAS 3008-40-0
Catalog: |
BB020439 |
Product Name: |
1,2-Cyclopentanedione |
CAS: |
3008-40-0 |
Synonyms: |
cyclopentane-1,2-dione; cyclopentane-1,2-dione |
IUPAC Name: | cyclopentane-1,2-dione |
Description: | 1,2-Cyclopentanedione (CAS# 3008-40-0) is a useful research chemical. |
Molecular Weight: | 98.10 |
Molecular Formula: | C5H6O2 |
Canonical SMILES: | C1CC(=O)C(=O)C1 |
InChI: | InChI=1S/C5H6O2/c6-4-2-1-3-5(4)7/h1-3H2 |
InChI Key: | CIISBNCSMVCNIP-UHFFFAOYSA-N |
MDL: | MFCD00045446 |
LogP: | 1.47880 |
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-214278038-U | Sample extraction element of volatile fragrant smell composition in essence feed liquid aqueous solution | 20210205 |
CN-112044373-A | Wood tar-wood vinegar composite base particle and preparation method and application thereof | 20200827 |
CN-112811970-A | Preparation method of 2-alkoxy-2-cyclopentene-1-ketone | 20200604 |
WO-2021195599-A1 | Mtorc1 modulators and uses thereof | 20200327 |
WO-2021178780-A1 | Indazoles and azaindazoles as lrrk2 inhibitors | 20200306 |
PMID | Publication Date | Title | Journal |
22889065 | 20120829 | Catalytic intermolecular C-alkylation of 1,2-diketones with simple olefins: a recyclable directing group strategy | Journal of the American Chemical Society |
21147335 | 20110115 | Effectiveness of different solid-phase microextraction fibres for differentiation of selected Madeira island fruits based on their volatile metabolite profile--identification of novel compounds | Talanta |
19541002 | 20090901 | Steroidal glycosides from the marine sponge Pandaros acanthifolium | Steroids |
19215105 | 20090319 | Synthesis of 5-hydroxycyclopent-2-enones from allenyl vinyl ketones via an interrupted Nazarov cyclization | Organic letters |
18351775 | 20080418 | Total Synthesis of the Four Enantiomerically Pure Diasteroisomers of the Phytoprostanes E1Type II and of the 15-E2t-Isoprostanes | The Journal of organic chemistry |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 98.036779430 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 98.036779430 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 34.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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