Propyl Ether

CAT: 0127-OR1078841-01Size: 25 mLDry Ice: NoHazardous: No

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CAS Number

111-43-3

Synonyms

Dipropyl Ether

MDL Number

MFCD00009376

Purity

>98.0%

Smiles

CCCOCCC

Chemical Information

Propyl ether

Di-n-propyl ether appears as a colorless liquid with a strong odor. Less dense than water and slightly soluble in water. Vapors are heavier than air. In high concentrations the vapors may be narcotic.

CAS Number	111-43-3
PubChem CID	8114
IUPAC Name	1-propoxypropane
Molecular Formula	C6H14O
Molecular Weight	102.17
XLogP	2
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	7
Formal Charge	0
Complexity	23

SMILES

CCCOCCC

InChI

InChI=1S/C6H14O/c1-3-5-7-6-4-2/h3-6H2,1-2H3

InChIKey

POLCUAVZOMRGSN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 111-43-3

CID: 8114

Formula: C6H14O

MW: 102.17

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	102.17
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	102.104465066
Monoisotopic Mass	102.104465066
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	23.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Propyl Ether

Chemical Information

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