L-Serine--hydrogen chloride (1/1)

CAS Number: 16428-75-4
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N[C@@H](CO)C(O)=O.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C3H7NO3
Molecular Weight
105.093
Drug-likeness
-10.074
CAS
16428-75-4
InChI key
STMOVTSFWYRCOB-DKWTVANSSA-N
SMILES
N[C@@H](CO)C(O)=O.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 16428-75-4
Molecule Name L-Serine--hydrogen chloride (1/1)
Molecular Formula HCl.C3H7NO3
SMILES N[C@@H](CO)C(O)=O.Cl
InChI InChI=1S/C3H7NO3.ClH/c4-2(1-5)3(6)7;/h2,5H,1,4H2,(H,6,7);1H/t2-;/m0./s1
InChI Key STMOVTSFWYRCOB-DKWTVANSSA-N
CanonicalSyTyLFy f5d2723e3bf1a729
TotalMolweight 141.554
Molecular Weight 105.093
MonoisotopicMass 105.042594
CLogP -3.9178
CLogS 0.101
H Acceptors 4
H Donors 3
TotalSurfaceArea 78.73
Relative PSA 0.69237
PolarSurfaceArea 83.55
Drug-likeness -10.074
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.71429
Molecula Flexibility 0.78429
Molecular Complexity 0.69315
Fragments 2
Non HAtoms 7
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 2
Sp3Atoms 5
Amines 1
AlkylAmines 1
BasicNitrogens 1
AcidicOxygens 1
StereoCon this enantiomer

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