3-Oxocyclobutyl Acetate - CAS 63930-59-6
Catalog: |
BB032327 |
Product Name: |
3-Oxocyclobutyl Acetate |
CAS: |
63930-59-6 |
Synonyms: |
acetic acid (3-oxocyclobutyl) ester; (3-oxocyclobutyl) acetate |
IUPAC Name: | (3-oxocyclobutyl) acetate |
Description: | 3-Oxocyclobutyl Acetate (CAS# 63930-59-6) is a useful research chemical. |
Molecular Weight: | 128.13 |
Molecular Formula: | C6H8O3 |
Canonical SMILES: | CC(=O)OC1CC(=O)C1 |
InChI: | InChI=1S/C6H8O3/c1-4(7)9-6-2-5(8)3-6/h6H,2-3H2,1H3 |
InChI Key: | FWHLIVHQAGFBOA-UHFFFAOYSA-N |
MDL: | MFCD11976057 |
LogP: | 0.28100 |
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 |
WO-2021203014-A1 | Pyrano[4,3-b]l ndole derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd) | 20200403 |
WO-2021154997-A1 | Inhibitors of apol1 and methods of using same | 20200129 |
WO-2021071832-A1 | Aryl heterobicyclic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
EP-3645516-A1 | Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis b infections | 20170627 |
WO-2019001420-A1 | HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING INFECTIONS WITH HEPATITIS B VIRUS | 20170627 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.047344113 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.047344113 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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