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2-Methoxy-5- (methoxymethoxy) pyridine

CAT: 0127-OR71082-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR71082-01Size:5 g
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CAS Number
431942-25-5
MDL Number
MFCD26386947
Purity
95%
Smiles
COCOc1ccc(OC)nc1

Chemical Information

2-Methoxy-5-(methoxymethoxy)pyridine
CAS Number431942-25-5
PubChem CID12027784
IUPAC Name2-methoxy-5-(methoxymethoxy)pyridine
Molecular FormulaC8H11NO3
Molecular Weight169.18
XLogP1.1
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity121
SMILES
COCOC1=CN=C(C=C1)OC
InChI
InChI=1S/C8H11NO3/c1-10-6-12-7-3-4-8(11-2)9-5-7/h3-5H,6H2,1-2H3
InChIKey
JWDZEPQEQCIVJH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methoxy-5-(methoxymethoxy)pyridine
CAS: 431942-25-5
CID: 12027784
Formula: C8H11NO3
MW: 169.18
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight169.18
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass169.07389321
Monoisotopic Mass169.07389321
Topological Polar Surface Area40.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity121
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