Ethyl 5-(3,5-Dimethoxyphenyl)pentanoate - CAS 197178-54-4
Catalog: |
BB066228 |
Product Name: |
Ethyl 5-(3,5-Dimethoxyphenyl)pentanoate |
CAS: |
197178-54-4 |
Synonyms: |
ethyl 5-(3,5-dimethoxyphenyl)pentanoate |
IUPAC Name: | ethyl 5-(3,5-dimethoxyphenyl)pentanoate |
Molecular Weight: | 266.33 |
Molecular Formula: | C15H22O4 |
Canonical SMILES: | CCOC(=O)CCCCC1=CC(=CC(=C1)OC)OC |
InChI: | InChI=1S/C15H22O4/c1-4-19-15(16)8-6-5-7-12-9-13(17-2)11-14(10-12)18-3/h9-11H,4-8H2,1-3H3 |
InChI Key: | NYVRUSPOKCTJSA-UHFFFAOYSA-N |
Complexity: | 243 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.15180918 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.15180918 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 44.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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