Ethyl 2-(4-iodophenoxy)acetate - CAS 90794-33-5
Catalog: |
BB053449 |
Product Name: |
Ethyl 2-(4-iodophenoxy)acetate |
CAS: |
90794-33-5 |
Synonyms: |
(4-iodophenoxy)acetic acid ethyl ester; Acetic acid, 2-(4-iodophenoxy)-, ethyl ester |
IUPAC Name: | ethyl 2-(4-iodophenoxy)acetate |
Molecular Weight: | 306.10 |
Molecular Formula: | C10H11IO3 |
Canonical SMILES: | CCOC(=O)COC1=CC=C(C=C1)I |
InChI: | InChI=1S/C10H11IO3/c1-2-13-10(12)7-14-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3 |
InChI Key: | LSDOOFJZRXYLSK-UHFFFAOYSA-N |
Purity: | 95% |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 305.97529 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 305.97529 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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