Prothiocarb hydrochloride [ISO]

CAS Number: 19622-19-6
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CCSC(NCCCN(C)C)=O.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C8H18N2OS
Molecular Weight
190.31
Drug-likeness
4.4321
CAS
19622-19-6
InChI key
NMFAMPYSJHIYMR-UHFFFAOYSA-N
SMILES
CCSC(NCCCN(C)C)=O.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 19622-19-6
Molecule Name Prothiocarb hydrochloride [ISO]
Molecular Formula HCl.C8H18N2OS
SMILES CCSC(NCCCN(C)C)=O.Cl
InChI InChI=1S/C8H18N2OS.ClH/c1-4-12-8(11)9-6-5-7-10(2)3;/h4-7H2,1-3H3,(H,9,11);1H
InChI Key NMFAMPYSJHIYMR-UHFFFAOYSA-N
CanonicalSyTyLFy 9c41755ef67dce9
TotalMolweight 226.771
Molecular Weight 190.31
MonoisotopicMass 190.113983
CLogP 0.9165
CLogS -1.184
H Acceptors 3
H Donors 1
TotalSurfaceArea 162.32
Relative PSA 0.28056
PolarSurfaceArea 57.64
Drug-likeness 4.4321
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.83333
Molecula Flexibility 0.81524
Molecular Complexity 0.46052
Fragments 2
Non HAtoms 12
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 6
Sp3Atoms 9
Symmetricatoms 1
Amides 1
Amines 1
AlkylAmines 1
BasicNitrogens 1

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