Ethyl 6-(chloromethyl)-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate - CAS 832740-12-2
Catalog: |
BB049872 |
Product Name: |
Ethyl 6-(chloromethyl)-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate |
CAS: |
832740-12-2 |
Synonyms: |
ethyl 6-(chloromethyl)-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate; Ethyl 6-(chloromethyl)-4-(4-methoxy-3-(methoxymethyl)phenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
IUPAC Name: | ethyl 6-(chloromethyl)-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate |
Description: | Ethyl 6-(chloromethyl)-4-[4-methoxy-3-(methoxymethyl)phenyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate (CAS# 832740-12-2 ) is a useful research chemical. |
Molecular Weight: | 368.8 |
Molecular Formula: | C17H21ClN2O5 |
Canonical SMILES: | CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)OC)COC)CCl |
InChI: | InChI=1S/C17H21ClN2O5/c1-4-25-16(21)14-12(8-18)19-17(22)20-15(14)10-5-6-13(24-3)11(7-10)9-23-2/h5-7,15H,4,8-9H2,1-3H3,(H2,19,20,22) |
InChI Key: | NIEHOVBDLOORJM-UHFFFAOYSA-N |
Boiling Point: | 472.6±45.0 °C at 760 mmHg |
Density: | 1.2±0.1 g/cm3 |
Complexity: | 525 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 368.1138995 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 368.1138995 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 85.9 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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