6-Chloro-3-(trifluoromethyl)picolinaldehyde - CAS 1245914-65-1
Catalog: |
BB055525 |
Product Name: |
6-Chloro-3-(trifluoromethyl)picolinaldehyde |
CAS: |
1245914-65-1 |
Synonyms: |
6-Chloro-3-(trifluoromethyl)-2-pyridinecarboxaldehyde |
IUPAC Name: | 6-chloro-3-(trifluoromethyl)pyridine-2-carbaldehyde |
Description: | 6-Chloro-3-(trifluoromethyl)picolinaldehyde (CAS# 1245914-65-1) is a useful research chemical for organic synthesis processes. |
Molecular Weight: | 209.55 |
Molecular Formula: | C7H3ClF3NO |
Canonical SMILES: | C1=CC(=NC(=C1C(F)(F)F)C=O)Cl |
InChI: | InChI=1S/C7H3ClF3NO/c8-6-2-1-4(7(9,10)11)5(3-13)12-6/h1-3H |
InChI Key: | YCRXWHRVPZXEMU-UHFFFAOYSA-N |
References: | Froidevaux, S., et al. From PCT Int. Appl. (2019), WO 2019137927 A1 20190718. |
Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.9855259 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.9855259 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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