L-Methionine hydrochloride

CAS Number: 12-4-6810
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CSCC[C@@H](C(O)=O)N.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C5H11NO2S
Molecular Weight
149.213
Drug-likeness
-13.321
CAS
12-4-6810
InChI key
OSUIUMQSEFFIKM-WCCKRBBISA-N
SMILES
CSCC[C@@H](C(O)=O)N.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 12-4-6810
Molecule Name L-Methionine hydrochloride
Molecular Formula HCl.C5H11NO2S
SMILES CSCC[C@@H](C(O)=O)N.Cl
InChI InChI=1S/C5H11NO2S.ClH/c1-9-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);1H/t4-;/m0./s1
InChI Key OSUIUMQSEFFIKM-WCCKRBBISA-N
CanonicalSyTyLFy e22c35ee82fc875a
TotalMolweight 185.674
Molecular Weight 149.213
MonoisotopicMass 149.051049
CLogP -2.3875
CLogS -1.051
H Acceptors 3
H Donors 2
TotalSurfaceArea 115.89
Relative PSA 0.50824
PolarSurfaceArea 88.62
Drug-likeness -13.321
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.77778
Molecula Flexibility 0.76248
Molecular Complexity 0.57565
Fragments 2
Non HAtoms 9
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 4
Sp3Atoms 7
Amines 1
AlkylAmines 1
BasicNitrogens 1
AcidicOxygens 1
StereoCon this enantiomer

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