(2-iodoethoxy)triisopropylsilane

CAS Number: 93550-77-7
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CC(C)[Si](C(C)C)(C(C)C)OCCI
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: high
Formula
C11H25OISi
Molecular Weight
328.305
Drug-likeness
-50.351
CAS
93550-77-7
InChI key
NCRMNHSZPLHRRW-UHFFFAOYSA-N
SMILES
CC(C)[Si](C(C)C)(C(C)C)OCCI
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 93550-77-7
Molecule Name (2-iodoethoxy)triisopropylsilane
Molecular Formula C11H25OISi
SMILES CC(C)[Si](C(C)C)(C(C)C)OCCI
InChI InChI=1S/C11H25IOSi/c1-9(2)14(10(3)4,11(5)6)13-8-7-12/h9-11H,7-8H2,1-6H3
InChI Key NCRMNHSZPLHRRW-UHFFFAOYSA-N
CanonicalSyTyLFy 17be2e72756b06f2
TotalMolweight 328.305
Molecular Weight 328.305
MonoisotopicMass 328.07194
CLogP 3.6697
CLogS -1.629
H Acceptors 1
TotalSurfaceArea 201.86
Relative PSA 0.049539
PolarSurfaceArea 9.23
Drug-likeness -50.351
Mutagenic high
Tumorigenic high
Reproductive Effective none
Irritant high
Nasty Functions prim. alkyl-bromide/iodide
Shape Index 0.5
Molecula Flexibility 0.86781
Molecular Complexity 0.45134
Fragments 1
Non HAtoms 14
NonCHAtoms 3
Electronegative Atoms 2
Rotatable Bond 6
Sp3Atoms 12
Symmetricatoms 7

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