Diethyl isopropylmalonate - CAS 759-36-4
Catalog: |
BB035443 |
Product Name: |
Diethyl isopropylmalonate |
CAS: |
759-36-4 |
Synonyms: |
diethyl 2-propan-2-ylpropanedioate |
IUPAC Name: | diethyl 2-propan-2-ylpropanedioate |
Description: | Diethyl Isopropylmalonate can be used to treat CCR2-mediated disease. |
Molecular Weight: | 202.25 |
Molecular Formula: | C10H18O4 |
Canonical SMILES: | CCOC(=O)C(C(C)C)C(=O)OCC |
InChI: | InChI=1S/C10H18O4/c1-5-13-9(11)8(7(3)4)10(12)14-6-2/h7-8H,5-6H2,1-4H3 |
InChI Key: | BYQFBFWERHXONI-UHFFFAOYSA-N |
Boiling Point: | 62 °C / 0.35 mmHg (lit.) |
Density: | 0.981 g/cm3 |
MDL: | MFCD00040491 |
LogP: | 1.38480 |
Publication Number | Title | Priority Date |
CN-111471208-A | Preparation process of flame-retardant polyurethane building insulation board | 20200604 |
CN-111471208-B | Preparation process of flame-retardant polyurethane building insulation board | 20200604 |
CN-111423454-A | Piperazine compound and application thereof in preparing chemokine receptor CCR2 antagonist | 20200424 |
CN-111423454-B | Piperazine compound and application thereof in preparing chemokine receptor CCR2 antagonist | 20200424 |
KR-20210066215-A | Catalyst for polymerization of polyolefin | 20191128 |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.12050905 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.12050905 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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