(2-Bromoethyl)trimethylsilane

CAS Number: 18156-67-7
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C[Si](C)(C)CCBr
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: high
Formula
C5H13BrSi
Molecular Weight
181.148
Drug-likeness
-72.074
CAS
18156-67-7
InChI key
HYRIFSNOTHOUQJ-UHFFFAOYSA-N
SMILES
C[Si](C)(C)CCBr
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 18156-67-7
Molecule Name (2-Bromoethyl)trimethylsilane
Molecular Formula C5H13BrSi
SMILES C[Si](C)(C)CCBr
InChI InChI=1S/C5H13BrSi/c1-7(2,3)5-4-6/h4-5H2,1-3H3
InChI Key HYRIFSNOTHOUQJ-UHFFFAOYSA-N
CanonicalSyTyLFy 99c7fdb2e5daaaff
TotalMolweight 181.148
Molecular Weight 181.148
MonoisotopicMass 179.996988
CLogP 3.3987
CLogS -4.124
TotalSurfaceArea 109.93
Drug-likeness -72.074
Mutagenic low
Tumorigenic high
Reproductive Effective high
Irritant high
Nasty Functions prim. alkyl-bromide/iodide
Shape Index 0.71429
Molecula Flexibility 0.80893
Molecular Complexity 0.4621
Fragments 1
Non HAtoms 7
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 2
Sp3Atoms 5
Symmetricatoms 2

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