3,4-Dibutoxy-3-cyclobutene-1,2-dione - CAS 2892-62-8
Catalog: |
BB020015 |
Product Name: |
3,4-Dibutoxy-3-cyclobutene-1,2-dione |
CAS: |
2892-62-8 |
Synonyms: |
3,4-dibutoxycyclobut-3-ene-1,2-dione |
IUPAC Name: | 3,4-dibutoxycyclobut-3-ene-1,2-dione |
Description: | 3,4-Dibutoxy-3-cyclobutene-1,2-dione (CAS# 2892-62-8) is a useful research chemical. |
Molecular Weight: | 226.27 |
Molecular Formula: | C12H18O4 |
Canonical SMILES: | CCCCOC1=C(C(=O)C1=O)OCCCC |
InChI: | InChI=1S/C12H18O4/c1-3-5-7-15-11-9(13)10(14)12(11)16-8-6-4-2/h3-8H2,1-2H3 |
InChI Key: | XBRWELTXMQSEIN-UHFFFAOYSA-N |
Boiling Point: | 121-122 °C (0.2 mmHg) |
Density: | 0.965 g/cm3 |
MDL: | MFCD00037150 |
LogP: | 1.98320 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021142291-A1 | Stimulation of hair growth | 20200110 |
WO-2021142030-A1 | Methods of treating conditions related to the s1p1 receptor | 20200106 |
WO-2021130492-A1 | Carboxy derivatives with antiinflammatory properties | 20191223 |
WO-2021022178-A1 | Substituted sulfonamide pyrrolopyridines as jak inhibitors | 20190731 |
WO-2021022186-A1 | Deuterated mk2 pathway inhibitors and methods of using the same | 20190731 |
PMID | Publication Date | Title | Journal |
24077527 | 20131101 | Squaric acid/4-aminoquinoline conjugates: novel potent antiplasmodial agents | European journal of medicinal chemistry |
22972052 | 20120912 | Topical treatments for cutaneous warts | The Cochrane database of systematic reviews |
21728175 | 20111001 | Delayed type hypersensitivity-induced myeloid-derived suppressor cells regulate autoreactive T cells | European journal of immunology |
21909196 | 20110801 | Does immunotherapy of viral warts provide beneficial effects when it is combined with conventional therapy? | Annals of dermatology |
21679832 | 20110701 | Cutaneous lymphoid hyperplasia related to squaric acid dibutyl ester | Journal of the American Academy of Dermatology |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.12050905 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.12050905 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 52.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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