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Methyl Propyl Ether

CAT: 0127-OR1078352-02Size: 500 mLDry Ice: NoHazardous: No
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CAT#:0127-OR1078352-02Size:500 mL
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CAS Number
557-17-5
Synonyms
1-Methoxypropane
MDL Number
MFCD00059399
Purity
>95.0%
Smiles
CCCOC

Chemical Information

Methyl propyl ether

Methyl propyl ether appears as a colorless volatile liquid with an ether-like odor. Less dense than water and insoluble in water. Vapors heavier than air. May be narcotic by inhalation in high concentrations. Used as a solvent and to make other chemicals.

CAS Number557-17-5
PubChem CID11182
IUPAC Name1-methoxypropane
Molecular FormulaC4H10O
Molecular Weight74.12
XLogP1.2
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count5
Formal Charge0
Complexity13
SMILES
CCCOC
InChI
InChI=1S/C4H10O/c1-3-4-5-2/h3-4H2,1-2H3
InChIKey
VNKYTQGIUYNRMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl propyl ether
CAS: 557-17-5
CID: 11182
Formula: C4H10O
MW: 74.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight74.12
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass74.073164938
Monoisotopic Mass74.073164938
Topological Polar Surface Area9.2 Ų
Heavy Atom Count5
Formal Charge0
Complexity13.1
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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