Methyl 2-(2-Bromoethyl)benzoate - CAS 25109-86-8
Catalog: |
BB018745 |
Product Name: |
Methyl 2-(2-Bromoethyl)benzoate |
CAS: |
25109-86-8 |
Synonyms: |
2-(2-bromoethyl)benzoic acid methyl ester; methyl 2-(2-bromoethyl)benzoate |
IUPAC Name: | methyl 2-(2-bromoethyl)benzoate |
Description: | Methyl 2-(2-Bromoethyl)benzoate (CAS# 25109-86-8) is a useful research chemical compound. |
Molecular Weight: | 243.10 |
Molecular Formula: | C10H11BrO2 |
Canonical SMILES: | COC(=O)C1=CC=CC=C1CCBr |
InChI: | InChI=1S/C10H11BrO2/c1-13-10(12)9-5-3-2-4-8(9)6-7-11/h2-5H,6-7H2,1H3 |
InChI Key: | ODGOVUCLDAPMKP-UHFFFAOYSA-N |
Appearance: | Liquid |
LogP: | 2.41060 |
Publication Number | Title | Priority Date |
WO-2021050992-A1 | Usp30 inhibitors and uses thereof | 20190911 |
CN-102850221-A | Synthesis method for 2-(2-bromoethyl)benzoic acid methyl ester | 20120910 |
US-2013231338-A1 | Benzofuran-2-sulfonamides derivatives as chemokine receptor modulators | 20120301 |
US-2015218119-A1 | Benzofuran-2-sulfonamides derivatives as chemokine receptor modulators | 20120301 |
US-8927544-B2 | Benzofuran-2-sulfonamides derivatives as chemokine receptor modulators | 20120301 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.99424 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.99424 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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