Ethyl 4-methyl-4-pentenoate - CAS 4911-54-0
Catalog: |
BB026635 |
Product Name: |
Ethyl 4-methyl-4-pentenoate |
CAS: |
4911-54-0 |
Synonyms: |
ethyl 4-methylpent-4-enoate |
IUPAC Name: | ethyl 4-methylpent-4-enoate |
Description: | Ethyl 4-methyl-4-pentenoate (CAS# 4911-54-0 ) is a useful research chemical. |
Molecular Weight: | 142.20 |
Molecular Formula: | C8H14O2 |
Canonical SMILES: | CCOC(=O)CCC(=C)C |
InChI: | InChI=1S/C8H14O2/c1-4-10-8(9)6-5-7(2)3/h2,4-6H2,1,3H3 |
InChI Key: | RRTBSPBUHUUTHR-UHFFFAOYSA-N |
Boiling Point: | 85 °C / 20 mmHg (lit.) |
Density: | 0.891 g/cm3 |
MDL: | MFCD00075160 |
LogP: | 1.90580 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-6945096-B1 | Adsorbent replacement method and fuel cell system | 20210416 |
JP-2020070280-A | Production intermediate of SMTP group or SMTP-7 and chemical production method thereof | 20181102 |
US-2020140450-A1 | Chemical method of producing smtp groups or smtp-7 andnintermediates used in the method | 20181102 |
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JP-2019003903-A | Fuel cell system | 20170619 |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.099379685 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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