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4- (Propan-2-yloxy) pyridine

CAT: 0926-DCA70819-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-DCA70819-01Size:100 mg
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CAS Number
53708-19-3
MDL Number
MFCD00982625
Smiles
CC (C) OC1=CC=NC=C1
Molecular Formula
C8H11NO
Molecular Weight
137.18 g/mol
Controlled
No

Chemical Information

4-Isopropoxypyridine
CAS Number53708-19-3
PubChem CID4527576
IUPAC Name4-propan-2-yloxypyridine
Molecular FormulaC8H11NO
Molecular Weight137.18
XLogP1.8
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity87
SMILES
CC(C)OC1=CC=NC=C1
InChI
InChI=1S/C8H11NO/c1-7(2)10-8-3-5-9-6-4-8/h3-7H,1-2H3
InChIKey
IHELYFQSNOJLTC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Isopropoxypyridine
CAS: 53708-19-3
CID: 4527576
Formula: C8H11NO
MW: 137.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight137.18
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass137.084063974
Monoisotopic Mass137.084063974
Topological Polar Surface Area22.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity87.3
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
PC10109742-Fluoro-3- (propan-2-yloxy) pyridine
OR957010-015-Chloro-2- (propan-2-yloxy) pyridine
OR1088886Methyl 2- (propan-2-yloxy) pyridine-4-carboxylate
OR1080074Methyl 2- (propan-2-yloxy) pyridine-3-carboxylate
OR9570433-Chloro-5-methyl-2- (propan-2-yloxy) pyridine
OR9570445-Chloro-3-methyl-2- (propan-2-yloxy) pyridine
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OR1087431-01Methyl 5-chloro-2- (propan-2-yloxy) pyridine-4-carboxylate
PC1013648-015-Fluoro-2- (propan-2-yloxy) pyridine-4-carboxylic acid
OR1086119-01Methyl 5-chloro-2- (propan-2-yloxy) pyridine-3-carboxylate

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