3-Bromoisoquinoline - CAS 34784-02-6
Catalog: |
BB022280 |
Product Name: |
3-Bromoisoquinoline |
CAS: |
34784-02-6 |
Synonyms: |
3-bromoisoquinoline; 3-bromoisoquinoline |
IUPAC Name: | 3-bromoisoquinoline |
Description: | 3-Bromoisoquinoline (CAS# 34784-02-6) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 208.05 |
Molecular Formula: | C9H6BrN |
Canonical SMILES: | C1=CC=C2C=NC(=CC2=C1)Br |
InChI: | InChI=1S/C9H6BrN/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H |
InChI Key: | ZWJYXJDEDLXUHU-UHFFFAOYSA-N |
Boiling Point: | 316.3 °C at 760 mmHg |
Density: | 1.564 g/cm3 |
MDL: | MFCD00234479 |
LogP: | 2.99730 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113461669-A | Novel androgen receptor degradation agent, preparation method and medical application | 20210322 |
KR-20210089290-A | Novel 1-phenyl-1H-pyrazole derivatives and use thereof | 20200107 |
CN-111004241-A | Organic compound and application thereof | 20191227 |
CN-113024435-A | Linbicyclic structure sigma-1 receptor inhibitors | 20191209 |
US-2021147386-A1 | Pyrrolidine and piperidine compounds | 20191106 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.96836 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.96836 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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