(2,3-Dichloropropyl)cyclopropane

CAS Number: 62021-37-8
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ClCC(CC1CC1)Cl
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: low
Formula
C6H10Cl2
Molecular Weight
153.051
Drug-likeness
-2.0421
CAS
62021-37-8
InChI key
MFEHSSHPMCSQFW-LURJTMIESA-N
SMILES
ClCC(CC1CC1)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: low | Reproductive effective: high
PropertyValue
CAS Number 62021-37-8
Molecule Name (2,3-Dichloropropyl)cyclopropane
Molecular Formula C6H10Cl2
SMILES ClCC(CC1CC1)Cl
InChI InChI=1S/C6H10Cl2/c7-4-6(8)3-5-1-2-5/h5-6H,1-4H2/t6-/m0/s1
InChI Key MFEHSSHPMCSQFW-LURJTMIESA-N
CanonicalSyTyLFy 795b5dd23d13024d
TotalMolweight 153.051
Molecular Weight 153.051
MonoisotopicMass 152.015954
CLogP 2.6147
CLogS -2.768
TotalSurfaceArea 110.88
Drug-likeness -2.0421
Mutagenic high
Tumorigenic high
Reproductive Effective high
Irritant low
Shape Index 0.75
Molecula Flexibility 0.60026
Molecular Complexity 0.51986
Fragments 1
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Sp3Atoms 6
Symmetricatoms 1
StereoCon racemate

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