(1Z)-N,N,N'-Trimethyl(phenyl)ethanimidamide

CAS Number: 60719-04-2
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CN(C)/C(/Cc1ccccc1)=N\C
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C11H16N2
Molecular Weight
176.262
Drug-likeness
2.105
CAS
60719-04-2
InChI key
ZUWSBKVTWBVHQL-QXMHVHEDSA-N
SMILES
CN(C)/C(/Cc1ccccc1)=N\C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 60719-04-2
Molecule Name (1Z)-N,N,N'-Trimethyl(phenyl)ethanimidamide
Molecular Formula C11H16N2
SMILES CN(C)/C(/Cc1ccccc1)=N\C
InChI InChI=1S/C11H16N2/c1-12-11(13(2)3)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3/b12-11-
InChI Key ZUWSBKVTWBVHQL-QXMHVHEDSA-N
CanonicalSyTyLFy faaeca08819a53a8
TotalMolweight 176.262
Molecular Weight 176.262
MonoisotopicMass 176.131348
CLogP 1.4894
CLogS -1.28
H Acceptors 2
TotalSurfaceArea 157.07
Relative PSA 0.095881
PolarSurfaceArea 15.6
Drug-likeness 2.105
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.61538
Molecula Flexibility 0.63545
Molecular Complexity 0.52258
Fragments 1
Non HAtoms 13
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 4
Symmetricatoms 3
BasicNitrogens 1

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