4-(2-Bromoethyl)benzaldehyde - CAS 7617-70-1
Catalog: |
BB035511 |
Product Name: |
4-(2-Bromoethyl)benzaldehyde |
CAS: |
7617-70-1 |
Synonyms: |
4-(2-bromoethyl)benzaldehyde; 4-(2-bromoethyl)benzaldehyde |
IUPAC Name: | 4-(2-bromoethyl)benzaldehyde |
Description: | 4-(2-Bromoethyl)benzaldehyde (CAS# 7617-70-1) is a useful research chemical. |
Molecular Weight: | 213.07 |
Molecular Formula: | C9H9BrO |
Canonical SMILES: | C1=CC(=CC=C1CCBr)C=O |
InChI: | InChI=1S/C9H9BrO/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4,7H,5-6H2 |
InChI Key: | WJEZEUJKYFXNKJ-UHFFFAOYSA-N |
LogP: | 2.43650 |
Publication Number | Title | Priority Date |
WO-2021155050-A1 | Kinase modulators, pharmaceutical compositions, and therapeutic applications | 20200129 |
WO-2020105701-A1 | Novel polymer-active drug conjugate and use thereof | 20181122 |
CN-112601751-A | Fused thiophene compounds | 20180613 |
US-2014235585-A1 | Substituted diaryl derivatives as sphingosine receptor modulators | 20130220 |
US-2014235613-A1 | Substituted diaryl azetidine derivatives as sphingosine receptor modulators | 20130220 |
Complexity: | 117 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.98368 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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