N,N-Dimethylformamide--hydrogen fluoride (1/1)

CAS Number: 61856-32-4
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CN(C)C=O.F
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: high
Formula
HF.C3H7NO
Molecular Weight
73.0946
Drug-likeness
0.34492
CAS
61856-32-4
InChI key
HSUXKCIDXHKULN-UHFFFAOYSA-N
SMILES
CN(C)C=O.F
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 61856-32-4
Molecule Name N,N-Dimethylformamide--hydrogen fluoride (1/1)
Molecular Formula HF.C3H7NO
SMILES CN(C)C=O.F
InChI InChI=1S/C3H7NO.FH/c1-4(2)3-5;/h3H,1-2H3;1H
InChI Key HSUXKCIDXHKULN-UHFFFAOYSA-N
CanonicalSyTyLFy a6a889a12ddf34be
TotalMolweight 93.1005
Molecular Weight 73.0946
MonoisotopicMass 73.052764
CLogP -0.4497
CLogS -0.258
H Acceptors 2
TotalSurfaceArea 67.86
Relative PSA 0.24447
PolarSurfaceArea 20.31
Drug-likeness 0.34492
Mutagenic high
Tumorigenic high
Reproductive Effective high
Irritant high
Shape Index 0.8
Molecula Flexibility 0.59124
Molecular Complexity 0.54931
Fragments 2
Non HAtoms 5
NonCHAtoms 2
Electronegative Atoms 2
Sp3Atoms 2
Symmetricatoms 1
Amides 1

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