Nitric acid--water (1/4)

CAS Number: 372966-98-8
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[O-][N+](O)=O.O.O.O.O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HNO3.H2O.H2O.H2O.H2O
Molecular Weight
63.0119
Drug-likeness
-5.509
CAS
372966-98-8
InChI key
DOEGOCZXAAGGFN-UHFFFAOYSA-N
SMILES
[O-][N+](O)=O.O.O.O.O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 372966-98-8
Molecule Name Nitric acid--water (1/4)
Molecular Formula HNO3.H2O.H2O.H2O.H2O
SMILES [O-][N+](O)=O.O.O.O.O
InChI InChI=1S/HNO3.4H2O/c2-1(3)4;;;;/h(H,2,3,4);4*1H2
InChI Key DOEGOCZXAAGGFN-UHFFFAOYSA-N
CanonicalSyTyLFy 4110c2bbf072238b
TotalMolweight 135.071
Molecular Weight 63.0119
MonoisotopicMass 62.995644
CLogP -0.8585
CLogS -1.108
H Acceptors 4
H Donors 1
TotalSurfaceArea 43.52
Relative PSA 1
PolarSurfaceArea 66.05
Drug-likeness -5.509
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 5
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 2
AcidicOxygens 2

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