Ethyl 4-Iodo-3-methylbenzoate - CAS 103204-07-5
Catalog: |
BB001048 |
Product Name: |
Ethyl 4-Iodo-3-methylbenzoate |
CAS: |
103204-07-5 |
Synonyms: |
4-iodo-3-methylbenzoic acid ethyl ester; ethyl 4-iodo-3-methylbenzoate |
IUPAC Name: | ethyl 4-iodo-3-methylbenzoate |
Description: | Ethyl 4-Iodo-3-methylbenzoate (CAS# 103204-07-5) is a useful research chemical. |
Molecular Weight: | 290.10 |
Molecular Formula: | C10H11IO2 |
Canonical SMILES: | CCOC(=O)C1=CC(=C(C=C1)I)C |
InChI: | InChI=1S/C10H11IO2/c1-3-13-10(12)8-4-5-9(11)7(2)6-8/h4-6H,3H2,1-2H3 |
InChI Key: | POCCTDZBWSWSQQ-UHFFFAOYSA-N |
LogP: | 2.77630 |
Publication Number | Title | Priority Date |
US-2017114062-A1 | Benzamide or benzamine compounds useful as anticancer agents for the treatment of human cancers | 20150706 |
WO-2005058871-A1 | Morpholinyl containing benzimidazoles as inhibitors of respiratory syncytial virus replication | 20031218 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 289.98038 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 289.98038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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