(1-Iodo-2-nitroethenyl)(trimethyl)silane

CAS Number: 922139-04-6
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C[Si](C)(C)C(I)=C[N+]([O-])=O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C5H10NO2ISi
Molecular Weight
271.125
Drug-likeness
-52.222
CAS
922139-04-6
InChI key
AVYGFFXPLHVAIV-UHFFFAOYSA-N
SMILES
C[Si](C)(C)C(I)=C[N+]([O-])=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 922139-04-6
Molecule Name (1-Iodo-2-nitroethenyl)(trimethyl)silane
Molecular Formula C5H10NO2ISi
SMILES C[Si](C)(C)C(I)=C[N+]([O-])=O
InChI InChI=1S/C5H10INO2Si/c1-10(2,3)5(6)4-7(8)9/h4H,1-3H3
InChI Key AVYGFFXPLHVAIV-UHFFFAOYSA-N
CanonicalSyTyLFy af4a36c83aacc31f
TotalMolweight 271.125
Molecular Weight 271.125
MonoisotopicMass 270.952554
CLogP 1.88
CLogS -1.499
H Acceptors 3
TotalSurfaceArea 138.44
Relative PSA 0.21973
PolarSurfaceArea 45.82
Drug-likeness -52.222
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.6
Molecula Flexibility 0.62892
Molecular Complexity 0.59947
Fragments 1
Non HAtoms 10
NonCHAtoms 5
Electronegative Atoms 4
Rotatable Bond 2
Sp3Atoms 4
Symmetricatoms 2
AcidicOxygens 1

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