N-Ethyl-3-bromobenzylamine - CAS 90389-91-6
Catalog: |
BB039835 |
Product Name: |
N-Ethyl-3-bromobenzylamine |
CAS: |
90389-91-6 |
Synonyms: |
N-[(3-bromophenyl)methyl]ethanamine; N-[(3-bromophenyl)methyl]ethanamine |
IUPAC Name: | N-[(3-bromophenyl)methyl]ethanamine |
Description: | N-Ethyl-3-bromobenzylamine (CAS# 90389-91-6) is a useful research chemical. |
Molecular Weight: | 214.10 |
Molecular Formula: | C9H12BrN |
Canonical SMILES: | CCNCC1=CC(=CC=C1)Br |
InChI: | InChI=1S/C9H12BrN/c1-2-11-7-8-4-3-5-9(10)6-8/h3-6,11H,2,7H2,1H3 |
InChI Key: | ZKUHSZJORZCOFE-UHFFFAOYSA-N |
Boiling Point: | 254.3 °C at 760 mmHg |
Density: | 1.307 g/cm3 |
LogP: | 2.94950 |
Publication Number | Title | Priority Date |
WO-2021072156-A1 | Oral complement factor d inhibitors | 20191009 |
US-2019153620-A1 | Libraries of diverse macrocyclic compounds and methods of making and using the same | 20160516 |
US-2017305924-A1 | Nargenicin compounds and uses thereof as antibacterial agents | 20141022 |
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PMID | Publication Date | Title | Journal |
6433022 | 19840901 | Benzylamines: synthesis and evaluation of antimycobacterial properties | Journal of medicinal chemistry |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.01531 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.01531 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 12 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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