3-Bromo-4-(chloromethyl)pyridine Hydrochloride - CAS 1418117-80-2
Catalog: |
BB009250 |
Product Name: |
3-Bromo-4-(chloromethyl)pyridine Hydrochloride |
CAS: |
1418117-80-2 |
Synonyms: |
3-bromo-4-(chloromethyl)pyridine;hydrochloride; 3-bromo-4-(chloromethyl)pyridine;hydrochloride |
IUPAC Name: | 3-bromo-4-(chloromethyl)pyridine;hydrochloride |
Description: | 3-Bromo-4-(chloromethyl)pyridine Hydrochloride (CAS# 1418117-80-2) is a useful research chemical. |
Molecular Weight: | 242.93 |
Molecular Formula: | C6H6BrCl2N |
Canonical SMILES: | C1=CN=CC(=C1CCl)Br.Cl |
InChI: | InChI=1S/C6H5BrClN.ClH/c7-6-4-9-2-1-5(6)3-8;/h1-2,4H,3H2;1H |
InChI Key: | HVVDOVGTIKBHCI-UHFFFAOYSA-N |
LogP: | 3.38490 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AU-2018244935-A1 | Naphthyridines as inhibitors of HPK1 | 20170330 |
CN-110678466-A | Naphthyridines as HPK1 inhibitors | 20170330 |
EP-3601284-A1 | Naphthyridines as inhibitors of hpk1 | 20170330 |
JP-2020512974-A | Naphthyridine as an inhibitor of HPK1 | 20170330 |
KR-20190136028-A | Naphthyridine as an HPK1 Inhibitor | 20170330 |
Complexity: | 89.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.90607 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.90607 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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