6-Bromo-5-methylindole - CAS 248602-16-6
Catalog: |
BB018644 |
Product Name: |
6-Bromo-5-methylindole |
CAS: |
248602-16-6 |
Synonyms: |
6-bromo-5-methyl-1H-indole; 6-bromo-5-methyl-1H-indole |
IUPAC Name: | 6-bromo-5-methyl-1H-indole |
Description: | 6-Bromo-5-methylindole (CAS# 248602-16-6) is a useful research chemical compound. |
Molecular Weight: | 210.07 |
Molecular Formula: | C9H8BrN |
Canonical SMILES: | CC1=C(C=C2C(=C1)C=CN2)Br |
InChI: | InChI=1S/C9H8BrN/c1-6-4-7-2-3-11-9(7)5-8(6)10/h2-5,11H,1H3 |
InChI Key: | DZPFAUCRIATHQM-UHFFFAOYSA-N |
Boiling Point: | 328.451 °C at 760 mmHg |
Density: | 1.564 g/cm3 |
LogP: | 3.23880 |
Publication Number | Title | Priority Date |
WO-2020191261-A1 | Indazoles as lrrk2 inhibitors | 20190321 |
WO-2020086503-A1 | Substituted indole and indazole compounds | 20181024 |
CN-112955450-A | Substituted indole and indazole compounds | 20181024 |
EP-3870583-A1 | Substituted indole and indazole compounds | 20181024 |
KR-20210080461-A | Substituted Indole and Indazole Compounds | 20181024 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.98401 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.98401 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 15.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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