trans,trans-1,4-Diacetoxy-1,3-butadiene - CAS 15910-11-9
Catalog: |
BB011493 |
Product Name: |
trans,trans-1,4-Diacetoxy-1,3-butadiene |
CAS: |
15910-11-9 |
Synonyms: |
[(1E,3E)-4-acetyloxybuta-1,3-dienyl] acetate |
IUPAC Name: | [(1E,3E)-4-acetyloxybuta-1,3-dienyl] acetate |
Description: | trans,trans-1,4-Diacetoxy-1,3-butadiene (CAS# 15910-11-9) is an intermediate in the synthesis of Conduritol D (C667000). Conduritol D is a compound useful in organic synthesis. |
Molecular Weight: | 170.16 |
Molecular Formula: | C8H10O4 |
Canonical SMILES: | CC(=O)OC=CC=COC(=O)C |
InChI: | InChI=1S/C8H10O4/c1-7(9)11-5-3-4-6-12-8(2)10/h3-6H,1-2H3/b5-3+,6-4+ |
InChI Key: | XBRCQTOOSIDDOJ-GGWOSOGESA-N |
Boiling Point: | 211.8 °C at 760 mmHg |
Density: | 1.099 g/cm3 |
MDL: | MFCD00145432 |
LogP: | 1.14000 |
Publication Number | Title | Priority Date |
WO-2021007141-A1 | Process for the synthesis of non-racemic cyclohexenes | 20190709 |
BR-102016015366-A2 | CHEMICAL ACID EXTRACTION PROCESS FROM CALOPHYLLUM BRASILIENSE PLANTS | 20160630 |
JP-2008251572-A | Substrate bonding apparatus and substrate bonding method | 20070329 |
JP-4784604-B2 | Manufacturing method of wafer with fixing agent | 20050530 |
JP-WO2006129458-A1 | Wafer with fixing agent and method for manufacturing wafer with fixing agent | 20050530 |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 2 |
Exact Mass: | 170.0579088 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.0579088 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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