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4- (Trichloromethyl) pyridine

CAT: 0926-XAA79640-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-XAA79640-01Size:250 mg
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CAS Number
22796-40-3
MDL Number
MFCD09743970
Smiles
C1=CN=CC=C1C (Cl) (Cl) Cl
Molecular Formula
C6H4Cl3N
Molecular Weight
196.5 g/mol
Controlled
No

Chemical Information

4-(Trichloromethyl)pyridine
CAS Number22796-40-3
PubChem CID89838
IUPAC Name4-(trichloromethyl)pyridine
Molecular FormulaC6H4Cl3N
Molecular Weight196.5
XLogP2.5
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity104
SMILES
C1=CN=CC=C1C(Cl)(Cl)Cl
InChI
InChI=1S/C6H4Cl3N/c7-6(8,9)5-1-3-10-4-2-5/h1-4H
InChIKey
JYQFHKYYTOIWOQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(Trichloromethyl)pyridine
CAS: 22796-40-3
CID: 89838
Formula: C6H4Cl3N
MW: 196.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight196.5
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass194.940932
Monoisotopic Mass194.940932
Topological Polar Surface Area12.9 Ų
Heavy Atom Count10
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AN EU 3294-013- (trichloromethyl) pyridine
270265-012-Chloro-6- (trichloromethyl) pyridine
sc-2745452-Chloro-5- (trichloromethyl) pyridine
416974-012-​Chloro-​6-​ (trichloromethyl) ​pyridine
OR55549-012-Chloro-3- (trichloromethyl) pyridine
230179-012-Chloro-6- (trichloromethyl) pyridine 99+%
OR9768-012,6-Dichloro-4- (trichloromethyl) pyridine
OR228362,6-dichloro-3- (trichloromethyl) pyridine
OR315029-012,3-Dichloro-5- (trichloromethyl) pyridine
sc-347376A3,4,5-trichloro-2- (trichloromethyl) pyridine

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