Methanamine, N-hydroxy-, hydrochloride

CAS Number: 4229-44-1
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CNO.Cl
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: none
Formula
HCl.CH5NO
Molecular Weight
47.0567
Drug-likeness
-1.5569
CAS
4229-44-1
InChI key
RGZRSLKIOCHTSI-UHFFFAOYSA-N
SMILES
CNO.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 4229-44-1
Molecule Name Methanamine, N-hydroxy-, hydrochloride
Molecular Formula HCl.CH5NO
SMILES CNO.Cl
InChI InChI=1S/CH5NO.ClH/c1-2-3;/h2-3H,1H3;1H
InChI Key RGZRSLKIOCHTSI-UHFFFAOYSA-N
CanonicalSyTyLFy 633857e915872d2f
TotalMolweight 83.5176
Molecular Weight 47.0567
MonoisotopicMass 47.037114
CLogP -0.8702
CLogS -0.452
H Acceptors 2
H Donors 2
TotalSurfaceArea 43.57
Relative PSA 0.56369
PolarSurfaceArea 32.26
Drug-likeness -1.5569
Mutagenic high
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 1
Fragments 2
Non HAtoms 3
NonCHAtoms 2
Electronegative Atoms 2
Sp3Atoms 3

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