(1R,2R)-2-Chlorocyclopropan-1-ol

CAS Number: 62150-38-3
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O[C@H](C1)[C@@H]1Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C3H5OCl
Molecular Weight
92.5247
Drug-likeness
-0.68627
CAS
62150-38-3
InChI key
FPRZZQZXVVNHMP-GBXIJSLDSA-N
SMILES
O[C@H](C1)[C@@H]1Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: high
PropertyValue
CAS Number 62150-38-3
Molecule Name (1R,2R)-2-Chlorocyclopropan-1-ol
Molecular Formula C3H5OCl
SMILES O[C@H](C1)[C@@H]1Cl
InChI InChI=1S/C3H5ClO/c4-2-1-3(2)5/h2-3,5H,1H2/t2-,3+/m1/s1
InChI Key FPRZZQZXVVNHMP-GBXIJSLDSA-N
CanonicalSyTyLFy ee14ae2f7bf95395
TotalMolweight 92.5247
Molecular Weight 92.5247
MonoisotopicMass 92.002892
CLogP 0.4589
CLogS -1.268
H Acceptors 1
H Donors 1
TotalSurfaceArea 60.53
Relative PSA 0.21642
PolarSurfaceArea 20.23
Drug-likeness -0.68627
Mutagenic none
Tumorigenic none
Reproductive Effective high
Irritant none
Shape Index 0.8
Molecular Complexity 0.89588
Fragments 1
Non HAtoms 5
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 2
Rings Closures 1
Small Rings 1
Sp3Atoms 4
StereoCon this enantiomer

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