Diethyl 4-oxopimelate - CAS 6317-49-3
Catalog: |
BB032039 |
Product Name: |
Diethyl 4-oxopimelate |
CAS: |
6317-49-3 |
Synonyms: |
diethyl 4-oxoheptanedioate |
IUPAC Name: | diethyl 4-oxoheptanedioate |
Description: | Diethyl 4-oxopimelate (CAS# 6317-49-3) is a useful research chemical. |
Molecular Weight: | 230.26 |
Molecular Formula: | C11H18O5 |
Canonical SMILES: | CCOC(=O)CCC(=O)CCC(=O)OCC |
InChI: | InChI=1S/C11H18O5/c1-3-15-10(13)7-5-9(12)6-8-11(14)16-4-2/h3-8H2,1-2H3 |
InChI Key: | ZGBUXZJMZBBISR-UHFFFAOYSA-N |
Boiling Point: | 144 °C / 0.6 mmHg |
Density: | 1.073 g/cm3 |
MDL: | MFCD00009210 |
LogP: | 1.24210 |
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-2020127508-A1 | Substituted oxopyridine derivatives | 20181221 |
CN-106380729-B | Novel PVC heat stabilizer | 20160830 |
EP-3397657-A1 | Non-phthalate catalyst system and its use in the polymerization of olefins | 20151231 |
EP-3397658-A1 | Non-phthalate catalyst system and its use in the polymerization of olefins | 20151231 |
EP-3397659-A1 | Non-phthalate catalyst system and its use in the polymerization of olefins | 20151231 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.11542367 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.11542367 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 69.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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