Ethoxy(triethyl)ammonium

CAS Number: 89410-41-3
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CC[N+](CC)(CC)OCC
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C8H20NO
Molecular Weight
146.253
Drug-likeness
-8.3309
CAS
89410-41-3
InChI key
JEUXFYHMXGPCFO-UHFFFAOYSA-N
SMILES
CC[N+](CC)(CC)OCC
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 89410-41-3
Molecule Name Ethoxy(triethyl)ammonium
Molecular Formula C8H20NO
SMILES CC[N+](CC)(CC)OCC
InChI InChI=1S/C8H20NO/c1-5-9(6-2,7-3)10-8-4/h5-8H2,1-4H3/q+1
InChI Key JEUXFYHMXGPCFO-UHFFFAOYSA-N
CanonicalSyTyLFy 1c96dde9f2c29358
TotalMolweight 146.253
Molecular Weight 146.253
MonoisotopicMass 146.154489
CLogP -0.4276
CLogS 1.158
H Acceptors 2
TotalSurfaceArea 133.46
Relative PSA 0.017833
PolarSurfaceArea 9.23
Drug-likeness -8.3309
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecula Flexibility 0.88257
Molecular Complexity 0.51986
Fragments 1
Non HAtoms 10
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 5
Sp3Atoms 10
Symmetricatoms 4

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