2-(Trimethylsilyl)ethan-1-amine--hydrogen chloride (1/1)

CAS Number: 18135-30-3
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C[Si](C)(C)CCN.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
HCl.C5H15NSi
Molecular Weight
117.267
Drug-likeness
-66.321
CAS
18135-30-3
InChI key
OECFYIVZLPNYAX-UHFFFAOYSA-N
SMILES
C[Si](C)(C)CCN.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 18135-30-3
Molecule Name 2-(Trimethylsilyl)ethan-1-amine--hydrogen chloride (1/1)
Molecular Formula HCl.C5H15NSi
SMILES C[Si](C)(C)CCN.Cl
InChI InChI=1S/C5H15NSi.ClH/c1-7(2,3)5-4-6;/h4-6H2,1-3H3;1H
InChI Key OECFYIVZLPNYAX-UHFFFAOYSA-N
CanonicalSyTyLFy 60a2726914b55d1f
TotalMolweight 153.728
Molecular Weight 117.267
MonoisotopicMass 117.097376
CLogP 1.7139
CLogS -3.15
H Acceptors 1
H Donors 1
TotalSurfaceArea 99.82
Relative PSA 0.15298
PolarSurfaceArea 26.02
Drug-likeness -66.321
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.71429
Molecula Flexibility 0.80893
Molecular Complexity 0.4621
Fragments 2
Non HAtoms 7
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 2
Sp3Atoms 6
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1

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