(2-Methylbutyl)arsonous dichloride

CAS Number: 64049-25-8
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CCC(C)C[As](Cl)Cl
Molecule Information
Mutagenic: low Tumorigenic: low Irritant: high
Formula
C5H11AsCl2
Molecular Weight
216.97
Drug-likeness
-0.98008
CAS
64049-25-8
InChI key
RCBTZGZPCSLNHD-YFKPBYRVSA-N
SMILES
CCC(C)C[As](Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
low
Handling Watch
Irritant: high | Reproductive effective: low
PropertyValue
CAS Number 64049-25-8
Molecule Name (2-Methylbutyl)arsonous dichloride
Molecular Formula C5H11AsCl2
SMILES CCC(C)C[As](Cl)Cl
InChI InChI=1S/C5H11AsCl2/c1-3-5(2)4-6(7)8/h5H,3-4H2,1-2H3/t5-/m0/s1
InChI Key RCBTZGZPCSLNHD-YFKPBYRVSA-N
CanonicalSyTyLFy c6b39e531bbb7b54
TotalMolweight 216.97
Molecular Weight 216.97
MonoisotopicMass 215.945373
CLogP 2.0754
CLogS -5.113
TotalSurfaceArea 115.63
Drug-likeness -0.98008
Mutagenic low
Tumorigenic low
Reproductive Effective low
Irritant high
Nasty Functions unwanted atom
Shape Index 0.75
Molecula Flexibility 0.83097
Molecular Complexity 0.64864
Fragments 1
Non HAtoms 8
NonCHAtoms 3
Electronegative Atoms 3
StereoCenters 1
Rotatable Bond 3
Sp3Atoms 5
Symmetricatoms 1
StereoCon racemate

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