3-bromo-2-(bromomethyl)pyridine - CAS 754131-60-7
Catalog: |
BB035314 |
Product Name: |
3-bromo-2-(bromomethyl)pyridine |
CAS: |
754131-60-7 |
Synonyms: |
3-bromo-2-(bromomethyl)pyridine; 3-bromo-2-(bromomethyl)pyridine |
IUPAC Name: | 3-bromo-2-(bromomethyl)pyridine |
Description: | 3-bromo-2-(bromomethyl)pyridine (CAS# 754131-60-7) is a useful research chemical. |
Molecular Weight: | 250.921 |
Molecular Formula: | C6H5Br2N |
Canonical SMILES: | C1=CC(=C(N=C1)CBr)Br |
InChI: | InChI=1S/C6H5Br2N/c7-4-6-5(8)2-1-3-9-6/h1-3H,4H2 |
InChI Key: | FVIZOBDAEIFYGH-UHFFFAOYSA-N |
Boiling Point: | 250.9 °C at 760 mmHg |
Density: | 1.955 g/cm3 |
LogP: | 2.73900 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021115286-A1 | Six-membered and five-membered aromatic ring derivative containing nitrogen heteroatoms which can be used as shp2 inhibitor | 20191210 |
US-2021155636-A1 | Substituted Macrocyclic Compounds and Related Methods of Treatment | 20191125 |
WO-2021108628-A1 | Substituted macrocyclic compounds and related methods of treatment | 20191125 |
WO-2021026047-A1 | Heteroaryl pyrrolidine and piperidine orexin receptor agonists | 20190808 |
WO-2020122093-A1 | Heterocyclic compound | 20181212 |
Complexity: | 87.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.87682 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.87887 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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