(1R)-2-(Trimethylsilyl)cyclopent-2-en-1-ol

CAS Number: 192047-36-2
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C[Si](C)(C)C1=CCC[C@H]1O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C8H16OSi
Molecular Weight
156.3
Drug-likeness
-47.805
CAS
192047-36-2
InChI key
QHFMPPFHQLQYGJ-SSDOTTSWSA-N
SMILES
C[Si](C)(C)C1=CCC[C@H]1O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 192047-36-2
Molecule Name (1R)-2-(Trimethylsilyl)cyclopent-2-en-1-ol
Molecular Formula C8H16OSi
SMILES C[Si](C)(C)C1=CCC[C@H]1O
InChI InChI=1S/C8H16OSi/c1-10(2,3)8-6-4-5-7(8)9/h6-7,9H,4-5H2,1-3H3/t7-/m1/s1
InChI Key QHFMPPFHQLQYGJ-SSDOTTSWSA-N
CanonicalSyTyLFy 357fbb3dd8657f29
TotalMolweight 156.3
Molecular Weight 156.3
MonoisotopicMass 156.097042
CLogP 2.4683
CLogS -1.667
H Acceptors 1
H Donors 1
TotalSurfaceArea 121.36
Relative PSA 0.10794
PolarSurfaceArea 20.23
Drug-likeness -47.805
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.5
Molecula Flexibility 0.46514
Molecular Complexity 0.65162
Fragments 1
Non HAtoms 10
NonCHAtoms 2
Electronegative Atoms 1
StereoCenters 1
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Sp3Atoms 7
Symmetricatoms 2
StereoCon this enantiomer

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