4-Oxepanone - CAS 62643-19-0
Catalog: |
BB031712 |
Product Name: |
4-Oxepanone |
CAS: |
62643-19-0 |
Synonyms: |
4-oxepanone; oxepan-4-one |
IUPAC Name: | oxepan-4-one |
Description: | 4-Oxepanone (CAS# 62643-19-0) is a useful research chemical. |
Molecular Weight: | 114.14 |
Molecular Formula: | C6H10O2 |
Canonical SMILES: | C1CC(=O)CCOC1 |
InChI: | InChI=1S/C6H10O2/c7-6-2-1-4-8-5-3-6/h1-5H2 |
InChI Key: | CTLGXFASUHKSGN-UHFFFAOYSA-N |
LogP: | 0.75600 |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021163727-A1 | Pikfyve kinase inhibitors | 20200211 |
WO-2020204733-A1 | A solvent drying composition and processes therfor | 20190403 |
WO-2020185096-A1 | An alcohol recovery solution, and method of use therefor | 20190308 |
AU-2018346086-A1 | A salt recovery solution and processes of use thereof | 20171003 |
CA-3075922-A1 | A salt recovery solution and processes of use thereof | 20171003 |
Complexity: | 88.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 114.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 114.068079557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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