1-Methyl-2-azetidinone - CAS 2679-13-2
Catalog: |
BB019363 |
Product Name: |
1-Methyl-2-azetidinone |
CAS: |
2679-13-2 |
Synonyms: |
1-methyl-2-azetidinone; 1-methylazetidin-2-one |
IUPAC Name: | 1-methylazetidin-2-one |
Description: | 1-Methyl-2-azetidinone (CAS# 2679-13-2 ) is a useful research chemical. |
Molecular Weight: | 85.10 |
Molecular Formula: | C4H7NO |
Canonical SMILES: | CN1CCC1=O |
InChI: | InChI=1S/C4H7NO/c1-5-3-2-4(5)6/h2-3H2,1H3 |
InChI Key: | QOEUNLQGZBSTBB-UHFFFAOYSA-N |
LogP: | -0.21360 |
Publication Number | Title | Priority Date |
JP-6945807-B1 | Pneumatic tires | 20200901 |
JP-6880541-B1 | Pneumatic tires | 20200828 |
JP-6819028-B1 | Pneumatic tires | 20200820 |
JP-6819026-B1 | Pneumatic tires | 20200804 |
JP-6819027-B1 | Pneumatic tires for passenger cars | 20200804 |
PMID | Publication Date | Title | Journal |
16834160 | 20050901 | Synthesis of beta-lactams by Ag+-induced ring expansion of 1-hydroxycyclopropylamines: a theoretical analysis | The journal of physical chemistry. A |
11583551 | 20011010 | Molecular dynamics simulations of the mononuclear zinc-beta-lactamase from Bacillus cereus complexed with benzylpenicillin and a quantum chemical study of the reaction mechanism | Journal of the American Chemical Society |
Complexity: | 79.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 85.052763847 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 85.052763847 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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