5,7-Dibromoindole - CAS 36132-08-8
Catalog: |
BB022874 |
Product Name: |
5,7-Dibromoindole |
CAS: |
36132-08-8 |
Synonyms: |
5,7-dibromo-1H-indole |
IUPAC Name: | 5,7-dibromo-1H-indole |
Description: | 5,7-Dibromoindole (CAS# 36132-08-8) is a useful research chemical. |
Molecular Weight: | 274.94 |
Molecular Formula: | C8H5Br2N |
Canonical SMILES: | C1=CNC2=C(C=C(C=C21)Br)Br |
InChI: | InChI=1S/C8H5Br2N/c9-6-3-5-1-2-11-8(5)7(10)4-6/h1-4,11H |
InChI Key: | JBAQNCIQGHTHGK-UHFFFAOYSA-N |
Boiling Point: | 368.5 °C at 760 mmHg |
Purity: | 95 % |
Density: | 2.048 g/cm3 |
Appearance: | White to yellow to tan powder |
MDL: | MFCD03090642 |
LogP: | 3.69290 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2020354353-A1 | Indole Compounds and Their Use | 20171120 |
US-2021179604-A1 | Indole Compounds and Their Use | 20171120 |
EP-3328379-A1 | Bis-heteroaryl derivatives as modulators of protein aggregation | 20150729 |
US-2018222899-A1 | Bis-heteroaryl derivatives as modulators of protein aggregation | 20150729 |
WO-2017020010-A1 | Bis-heteroaryl derivatives as modulators of protein aggregation | 20150729 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 274.87682 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 272.87887 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 15.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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