N-Hydroxy-N-methoxymethanamine--hydrogen chloride (1/1)

CAS Number: 215189-83-6
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CN(O)OC.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C2H7NO2
Molecular Weight
77.0826
Drug-likeness
-0.72451
CAS
215189-83-6
InChI key
ZXHAFEZNUNBRCT-UHFFFAOYSA-N
SMILES
CN(O)OC.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 215189-83-6
Molecule Name N-Hydroxy-N-methoxymethanamine--hydrogen chloride (1/1)
Molecular Formula HCl.C2H7NO2
SMILES CN(O)OC.Cl
InChI InChI=1S/C2H7NO2.ClH/c1-3(4)5-2;/h4H,1-2H3;1H
InChI Key ZXHAFEZNUNBRCT-UHFFFAOYSA-N
CanonicalSyTyLFy d460e1838ed32fa6
TotalMolweight 113.544
Molecular Weight 77.0826
MonoisotopicMass 77.047679
CLogP -1.1584
CLogS 0.299
H Acceptors 3
H Donors 1
TotalSurfaceArea 64.67
Relative PSA 0.41209
PolarSurfaceArea 32.7
Drug-likeness -0.72451
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.8
Molecula Flexibility 0.65063
Molecular Complexity 0.69315
Fragments 2
Non HAtoms 5
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 1
Sp3Atoms 5

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