Dimethyl (2-oxo-5-phenylpentyl)phosphonate - CAS 41640-05-5
Catalog: |
BB043711 |
Product Name: |
Dimethyl (2-oxo-5-phenylpentyl)phosphonate |
CAS: |
41640-05-5 |
Synonyms: |
1-Dimethoxyphosphoryl-5-phenyl-pentan-2-one; Phosphonic acid, (2-oxo-5-phenylpentyl)-, dimethyl ester; CTK1D3714; DTXSID10712268 |
IUPAC Name: | 1-dimethoxyphosphoryl-5-phenylpentan-2-one |
Description: | Dimethyl (2-oxo-5-phenylpentyl)phosphonate (CAS# 41640-05-5 ) is a useful research chemical. |
Molecular Weight: | 270.27 |
Molecular Formula: | C13H19O4P |
Canonical SMILES: | COP(=O)(CC(=O)CCCC1=CC=CC=C1)OC |
InChI: | InChI=1S/C13H19O4P/c1-16-18(15,17-2)11-13(14)10-6-9-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11H2,1-2H3 |
InChI Key: | ZVTZGGAWAWFQOO-UHFFFAOYSA-N |
Purity: | 99 % |
Complexity: | 289 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 270.10209608 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 270.10209608 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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