4-Bromo-8-fluoro-2-methylquinoline - CAS 1070879-49-0
Catalog: |
BB001972 |
Product Name: |
4-Bromo-8-fluoro-2-methylquinoline |
CAS: |
1070879-49-0 |
Synonyms: |
4-bromo-8-fluoro-2-methylquinoline |
IUPAC Name: | 4-bromo-8-fluoro-2-methylquinoline |
Description: | 4-Bromo-8-fluoro-2-methylquinoline (CAS# 1070879-49-0) is a useful research chemical. |
Molecular Weight: | 240.07 |
Molecular Formula: | C10H7BrFN |
Canonical SMILES: | CC1=NC2=C(C=CC=C2F)C(=C1)Br |
InChI: | InChI=1S/C10H7BrFN/c1-6-5-8(11)7-3-2-4-9(12)10(7)13-6/h2-5H,1H3 |
InChI Key: | XETQAKPBSIDNFG-UHFFFAOYSA-N |
Purity: | 95 % |
LogP: | 3.44480 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
EP-3036228-A1 | New 6-alkynyl pyridine | 20130823 |
EP-3036228-B1 | New 6-alkynyl pyridine compounds | 20130823 |
JP-2016528273-A | New 6-alkynylpyridine | 20130823 |
JP-6338665-B2 | New 6-alkynylpyridine | 20130823 |
TW-201605798-A | Novel 6-alkynylpyridine | 20130823 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.97459 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.97459 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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