7-Bromo-4-chloro-8-methylquinoline - CAS 1189106-50-0
Catalog: |
BB004332 |
Product Name: |
7-Bromo-4-chloro-8-methylquinoline |
CAS: |
1189106-50-0 |
Synonyms: |
7-bromo-4-chloro-8-methylquinoline |
IUPAC Name: | 7-bromo-4-chloro-8-methylquinoline |
Description: | 7-Bromo-4-chloro-8-methylquinoline (CAS# 1189106-50-0) is a useful research chemical compound. |
Molecular Weight: | 256.53 |
Molecular Formula: | C10H7BrClN |
Canonical SMILES: | CC1=C(C=CC2=C(C=CN=C12)Cl)Br |
InChI: | InChI=1S/C10H7BrClN/c1-6-8(11)3-2-7-9(12)4-5-13-10(6)7/h2-5H,1H3 |
InChI Key: | UPJFHRDSKRYSLG-UHFFFAOYSA-N |
Purity: | 95 % |
LogP: | 3.95910 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
EP-2788332-A1 | Bicyclic aryl and heteroaryl sodium channel inhibitors | 20111207 |
TW-201336825-A | Sodium channel inhibitors of bicyclic aryl and heteroaryl compounds | 20111207 |
US-2013150339-A1 | Bicyclic Aryl and Heteroaryl Sodium Channel Inhibitors | 20111207 |
US-9012443-B2 | Bicyclic aryl and heteroaryl sodium channel inhibitors | 20111207 |
WO-2013086229-A1 | Bicyclic aryl and heteroaryl sodium channel inhibitors | 20111207 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.94504 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.94504 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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