4-(Trifluoromethyl)indole-3-carbaldehyde - CAS 959236-12-5
Catalog: |
BB041883 |
Product Name: |
4-(Trifluoromethyl)indole-3-carbaldehyde |
CAS: |
959236-12-5 |
Synonyms: |
4-(trifluoromethyl)-1H-indole-3-carboxaldehyde; 4-(trifluoromethyl)-1H-indole-3-carbaldehyde |
IUPAC Name: | 4-(trifluoromethyl)-1H-indole-3-carbaldehyde |
Description: | 4-(Trifluoromethyl)indole-3-carbaldehyde (CAS# 959236-12-5 ) is a useful research chemical. |
Molecular Weight: | 213.16 |
Molecular Formula: | C10H6F3NO |
Canonical SMILES: | C1=CC(=C2C(=C1)NC=C2C=O)C(F)(F)F |
InChI: | InChI=1S/C10H6F3NO/c11-10(12,13)7-2-1-3-8-9(7)6(5-15)4-14-8/h1-5,14H |
InChI Key: | YGSKOERZFUTESV-UHFFFAOYSA-N |
LogP: | 2.99920 |
Publication Number | Title | Priority Date |
US-2020199118-A1 | Antibacterial compounds | 20170316 |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
US-2013281324-A1 | Bi-functinal complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2009108551-A2 | Heteroaryl amide analogues | 20080225 |
Complexity: | 254 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.0401483 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.0401483 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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