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2- (2-Methoxyethoxy) -5- (methylthio) pyridine

CAT: 0127-OR1089611-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1089611-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2764731-71-5
MDL Number
MFCD34759451
Purity
97%
Smiles
C1 (cnc (cc1) OCCOC) SC

Chemical Information

2-(2-Methoxyethoxy)-5-(methylthio)pyridine
CAS Number2764731-71-5
PubChem CID164893510
IUPAC Name2-(2-methoxyethoxy)-5-methylsulfanylpyridine
Molecular FormulaC9H13NO2S
Molecular Weight199.27
XLogP1.5
Topological Polar Surface Area56.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count13
Formal Charge0
Complexity135
SMILES
COCCOC1=NC=C(C=C1)SC
InChI
InChI=1S/C9H13NO2S/c1-11-5-6-12-9-4-3-8(13-2)7-10-9/h3-4,7H,5-6H2,1-2H3
InChIKey
RSCLNOLJSKUZRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-Methoxyethoxy)-5-(methylthio)pyridine
CAS: 2764731-71-5
CID: 164893510
Formula: C9H13NO2S
MW: 199.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight199.27
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass199.06669983
Monoisotopic Mass199.06669983
Topological Polar Surface Area56.7 Ų
Heavy Atom Count13
Formal Charge0
Complexity135
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