Formaldehyde, oxime, hydrochloride (1:1)

CAS Number: 11-8-3473
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C=NO.Cl
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: none
Formula
HCl.CH3NO
Molecular Weight
45.0408
Drug-likeness
-2.13
CAS
11-8-3473
InChI key
ZNGCJNWNSDXSQQ-UHFFFAOYSA-N
SMILES
C=NO.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 11-8-3473
Molecule Name Formaldehyde, oxime, hydrochloride (1:1)
Molecular Formula HCl.CH3NO
SMILES C=NO.Cl
InChI InChI=1S/CH3NO.ClH/c1-2-3;/h3H,1H2;1H
InChI Key ZNGCJNWNSDXSQQ-UHFFFAOYSA-N
CanonicalSyTyLFy 2adc14706cef1f6e
TotalMolweight 81.5018
Molecular Weight 45.0408
MonoisotopicMass 45.021464
CLogP 0.438
CLogS -0.955
H Acceptors 2
H Donors 1
TotalSurfaceArea 42.65
Relative PSA 0.57702
PolarSurfaceArea 32.59
Drug-likeness -2.13
Mutagenic high
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 1
Fragments 2
Non HAtoms 3
NonCHAtoms 2
Electronegative Atoms 2
Sp3Atoms 1

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