(2,5-Dibromothiophen-3-yl)(trimethyl)silane

CAS Number: 38611-18-6
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C[Si](C)(C)c(cc(s1)Br)c1Br
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C7H10Br2SSi
Molecular Weight
314.116
Drug-likeness
-50.123
CAS
38611-18-6
InChI key
DNOFRKOBCHBBAJ-UHFFFAOYSA-N
SMILES
C[Si](C)(C)c(cc(s1)Br)c1Br
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 38611-18-6
Molecule Name (2,5-Dibromothiophen-3-yl)(trimethyl)silane
Molecular Formula C7H10Br2SSi
SMILES C[Si](C)(C)c(cc(s1)Br)c1Br
InChI InChI=1S/C7H10Br2SSi/c1-11(2,3)5-4-6(8)10-7(5)9/h4H,1-3H3
InChI Key DNOFRKOBCHBBAJ-UHFFFAOYSA-N
CanonicalSyTyLFy 940e632ec0da3e7b
TotalMolweight 314.116
Molecular Weight 314.116
MonoisotopicMass 311.863919
CLogP 5.1173
CLogS -3.607
TotalSurfaceArea 156.74
Relative PSA 0.1299
PolarSurfaceArea 28.24
Drug-likeness -50.123
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.54545
Molecula Flexibility 0.46369
Molecular Complexity 0.7167
Fragments 1
Non HAtoms 11
NonCHAtoms 4
Electronegative Atoms 3
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 5
Sp3Atoms 3
Symmetricatoms 2

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