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Ether, 2-chloropropyl methyl,Propane, 2-chloro-1-methoxy-, 2-chloro-1-

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摘 要:Ether, 2-chloropropyl methyl,Propane, 2-chloro-1-methoxy-, 2-chloro-1-methoxypropane,Canonical SMILES: CC(COC)Cl,InChI: InChI=1/C4H9ClO/c1-4(5)3-6-2/h4H,3H2,1-2H3,Molecular Weight108.56666 [g/mol]Molecular FormulaC4H9ClOXLogP1.1H-Bond Donor0H-Bond Ac
[Synonyms]
Ether, 2-chloropropyl methyl
Propane, 2-chloro-1-methoxy-

[Structure]
Ether, 2-chloropropyl methyl,Propane, 2-chloro-1-methoxy-, 2-chloro-1-

[ Properties Computed from Structure]
Molecular Weight108.56666 [g/mol]
Molecular FormulaC4H9ClO
XLogP1.1
H-Bond Donor0
H-Bond Acceptor1
Rotatable Bond Count2
Exact Mass108.034193
MonoIsotopic Mass108.034193
Topological Polar Surface Area9.2
Heavy Atom Count6
Formal Charge0
Complexity30.7
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count1
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 2-chloro-1-methoxypropane
Canonical SMILES: CC(COC)Cl
InChI: InChI=1/C4H9ClO/c1-4(5)3-6-2/h4H,3H2,1-2H3

 
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