(2S)-2-{2-[(Trimethylsilyl)oxy]propan-2-yl}pyrrolidine

CAS Number: 917773-68-3
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CC(C)([C@H]1NCCC1)O[Si](C)(C)C
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C10H23NOSi
Molecular Weight
201.385
Drug-likeness
-56.556
CAS
917773-68-3
InChI key
DSDXFYLHHGULCR-VIFPVBQESA-N
SMILES
CC(C)([C@H]1NCCC1)O[Si](C)(C)C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 917773-68-3
Molecule Name (2S)-2-{2-[(Trimethylsilyl)oxy]propan-2-yl}pyrrolidine
Molecular Formula C10H23NOSi
SMILES CC(C)([C@H]1NCCC1)O[Si](C)(C)C
InChI InChI=1S/C10H23NOSi/c1-10(2,12-13(3,4)5)9-7-6-8-11-9/h9,11H,6-8H2,1-5H3/t9-/m0/s1
InChI Key DSDXFYLHHGULCR-VIFPVBQESA-N
CanonicalSyTyLFy 10a024739df35f02
TotalMolweight 201.385
Molecular Weight 201.385
MonoisotopicMass 201.154891
CLogP 2.7054
CLogS -1.449
H Acceptors 2
H Donors 1
TotalSurfaceArea 160.45
Relative PSA 0.13375
PolarSurfaceArea 21.26
Drug-likeness -56.556
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.53846
Molecula Flexibility 0.6577
Molecular Complexity 0.61893
Fragments 1
Non HAtoms 13
NonCHAtoms 3
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Sp3Atoms 12
Symmetricatoms 3
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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