1,4-Diacetoxy-2-butene - CAS 18621-75-5
Catalog: |
BB014285 |
Product Name: |
1,4-Diacetoxy-2-butene |
CAS: |
18621-75-5 |
Synonyms: |
acetic acid [(E)-4-acetyloxybut-2-enyl] ester; [(E)-4-acetyloxybut-2-enyl] acetate |
IUPAC Name: | [(E)-4-acetyloxybut-2-enyl] acetate |
Description: | 1,4-Diacetoxy-2-butene (CAS# 18621-75-5) is a useful research chemical compound. |
Molecular Weight: | 172.18 |
Molecular Formula: | C8H12O4 |
Canonical SMILES: | CC(=O)OCC=CCOC(=O)C |
InChI: | InChI=1S/C8H12O4/c1-7(9)11-5-3-4-6-12-8(2)10/h3-4H,5-6H2,1-2H3/b4-3+ |
InChI Key: | VZUAUHWZIKOMFC-ONEGZZNKSA-N |
Boiling Point: | 230.9 °C at 760 mmHg |
Density: | 1.068 g/cm3 |
LogP: | 0.66880 |
Publication Number | Title | Priority Date |
CN-111389455-A | Method for synthesizing 1-butene-3, 4-diol by liquid-solid phase catalysis | 20200403 |
CN-111423309-A | Method for synthesizing 1-butene-3, 4-diol through gas-solid phase continuous isomerization | 20200403 |
WO-2021196340-A1 | Method for liquid-solid phase catalytic synthesis of 1-butene-3,4-diol | 20200403 |
WO-2021200153-A1 | Support material for additive manufacturing, and method for manufacturing additive-manufacturing article and three-dimensional structure using same | 20200331 |
WO-2021200134-A1 | Package of oxyalkylene group-containing pva-based resin, and method for producing same | 20200330 |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 172.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.07355886 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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