7-Bromoindole-3-carboxaldehyde - CAS 115666-21-2
Catalog: |
BB003605 |
Product Name: |
7-Bromoindole-3-carboxaldehyde |
CAS: |
115666-21-2 |
Synonyms: |
7-bromo-1H-indole-3-carbaldehyde |
IUPAC Name: | 7-bromo-1H-indole-3-carbaldehyde |
Description: | 7-Bromoindole-3-carboxaldehyde (CAS# 115666-21-2) is a useful research chemical. |
Molecular Weight: | 224.05 |
Molecular Formula: | C9H6BrNO |
Canonical SMILES: | C1=CC2=C(C(=C1)Br)NC=C2C=O |
InChI: | InChI=1S/C9H6BrNO/c10-8-3-1-2-7-6(5-12)4-11-9(7)8/h1-5,11H |
InChI Key: | MGPMWCBAOQWENZ-UHFFFAOYSA-N |
Appearance: | Solid |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.74290 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-108329249-A | A kind of method of synthesis of indole -3- benzaldehyde compounds | 20180209 |
CN-108329249-B | Method for synthesizing indole-3-formaldehyde compound | 20180209 |
US-2016324992-A1 | Identification and treatment of vulnerable plaques | 20150506 |
AU-2013381790-A1 | Use of indole compounds for fat reduction and skin and soft tissue tightening | 20130313 |
US-10258605-B2 | Use of indole compounds for fat reduction and skin and soft tissue tightening | 20130313 |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.96328 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.96328 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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