N-Methylmethanamine hydrochloride

CAS Number: 506-59-2
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CNC.Cl
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: high
Formula
HCl.C2H7N
Molecular Weight
45.0846
Drug-likeness
-1.204
CAS
506-59-2
InChI key
IQDGSYLLQPDQDV-UHFFFAOYSA-N
SMILES
CNC.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 506-59-2
Molecule Name N-Methylmethanamine hydrochloride
Molecular Formula HCl.C2H7N
SMILES CNC.Cl
InChI InChI=1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H
InChI Key IQDGSYLLQPDQDV-UHFFFAOYSA-N
CanonicalSyTyLFy 9add3ce4ac02d30a
TotalMolweight 81.5455
Molecular Weight 45.0846
MonoisotopicMass 45.057849
CLogP -0.4021
CLogS -0.169
H Acceptors 1
H Donors 1
TotalSurfaceArea 49.48
Relative PSA 0.23161
PolarSurfaceArea 12.03
Drug-likeness -1.204
Mutagenic high
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 1
Fragments 2
Non HAtoms 3
NonCHAtoms 1
Electronegative Atoms 1
Sp3Atoms 3
Symmetricatoms 1
Amines 1
AlkylAmines 1
BasicNitrogens 1

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