(1-{[Tri(propan-2-yl)silyl]oxy}cyclopropyl)methanol

CAS Number: 205756-60-1
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CC(C)[Si](C(C)C)(C(C)C)OC1(CO)CC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C13H28O2Si
Molecular Weight
244.449
Drug-likeness
-51.082
CAS
205756-60-1
InChI key
MKRIUHPGGXWSRT-UHFFFAOYSA-N
SMILES
CC(C)[Si](C(C)C)(C(C)C)OC1(CO)CC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 205756-60-1
Molecule Name (1-{[Tri(propan-2-yl)silyl]oxy}cyclopropyl)methanol
Molecular Formula C13H28O2Si
SMILES CC(C)[Si](C(C)C)(C(C)C)OC1(CO)CC1
InChI InChI=1S/C13H28O2Si/c1-10(2)16(11(3)4,12(5)6)15-13(9-14)7-8-13/h10-12,14H,7-9H2,1-6H3
InChI Key MKRIUHPGGXWSRT-UHFFFAOYSA-N
CanonicalSyTyLFy be16dd907bc3a357
TotalMolweight 244.449
Molecular Weight 244.449
MonoisotopicMass 244.185857
CLogP 2.5517
CLogS -1.571
H Acceptors 2
H Donors 1
TotalSurfaceArea 192.6
Relative PSA 0.11994
PolarSurfaceArea 29.46
Drug-likeness -51.082
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.4375
Molecula Flexibility 0.81795
Molecular Complexity 0.49511
Fragments 1
Non HAtoms 16
NonCHAtoms 3
Electronegative Atoms 2
Rotatable Bond 6
Rings Closures 1
Small Rings 1
Sp3Atoms 15
Symmetricatoms 8

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