(2H3)Methanol

CAS Number: 1849-29-2
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[2H]C([2H])([2H])O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
CHOD3
Molecular Weight
35.0602
Drug-likeness
-2.2721
CAS
1849-29-2
InChI key
OKKJLVBELUTLKV-FIBGUPNXSA-N
SMILES
[2H]C([2H])([2H])O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1849-29-2
Molecule Name (2H3)Methanol
Molecular Formula CHOD3
SMILES [2H]C([2H])([2H])O
InChI InChI=1S/CH4O/c1-2/h2H,1H3/i1D3
InChI Key OKKJLVBELUTLKV-FIBGUPNXSA-N
CanonicalSyTyLFy bfb7e5420a5eaab6
TotalMolweight 35.0602
Molecular Weight 35.0602
MonoisotopicMass 35.04474
CLogP -0.3558
CLogS -0.177
H Acceptors 1
H Donors 1
TotalSurfaceArea 32.11
Relative PSA 0.40797
PolarSurfaceArea 20.23
Drug-likeness -2.2721
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.6
Molecular Complexity 0.54931
Fragments 1
Non HAtoms 5
NonCHAtoms 4
Electronegative Atoms 1
Sp3Atoms 2
Symmetricatoms 2

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