Ethanamine, N-methyl-, hydrochloride (1:1)

CAS Number: 624-60-2
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CCNC.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C3H9N
Molecular Weight
59.1115
Drug-likeness
-0.017712
CAS
624-60-2
InChI key
GEHLEADVHVVTET-UHFFFAOYSA-N
SMILES
CCNC.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 624-60-2
Molecule Name Ethanamine, N-methyl-, hydrochloride (1:1)
Molecular Formula HCl.C3H9N
SMILES CCNC.Cl
InChI InChI=1S/C3H9N.ClH/c1-3-4-2;/h4H,3H2,1-2H3;1H
InChI Key GEHLEADVHVVTET-UHFFFAOYSA-N
CanonicalSyTyLFy 58678c3dca490d0d
TotalMolweight 95.5724
Molecular Weight 59.1115
MonoisotopicMass 59.073499
CLogP 0.0042
CLogS -0.469
H Acceptors 1
H Donors 1
TotalSurfaceArea 63.24
Relative PSA 0.18121
PolarSurfaceArea 12.03
Drug-likeness -0.017712
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 1
Molecula Flexibility 0.43303
Fragments 2
Non HAtoms 4
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 1
Sp3Atoms 4
Amines 1
AlkylAmines 1
BasicNitrogens 1

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