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Common name


potassium azide

Formula


KN3

CAS


20762-60-1

IUPAC name


potassium azide

SMILES


[K+].[N-]=N[N]

INCHI


InChI=1S/K.N3/c;1-3-2/q+1;-1

Physicochemical Properties

Molecular weight:

45.033

Molar refractivity:

8.014

Num. bonds:

2

Num. double bonds:

1

Num. triple bonds:

0

Num. heavy atoms:

3

Num. nitrogen atom:

3

Num. oxygen atoms:

0

Num. sulphur atoms :

0

Num. P atoms:

0

Num. halogen atoms:

0

Num. H-bond acc:

3

Num. H-bond donors:

2

Complexity of system:

2.03

Lipophilicity

ALogP:

-0.194

MLogP:

1.13

XLogP:

-1.143

Water Solubility

CLogS:

0.941

Geometric

PPSA-1:

109.416

PNSA-1:

159.279

RPCS:

21.417

RNCS:

11.465

THSA:

189.849

TPSA:

78.846

RHSA:

0.707

RPSA:

0.293

Electrostatic

RPCG:

0.421

RNCG:

0.409

Flexibility

Num. Rot. bonds: 0

0

Frac. of Rot. bonds:

0

AgroPAD

Photostability

Num. arom. bonds:

0

Num. arom. atoms:

0

Num. arom. rings:

0

Num. rings:

0

Topological

topoRadius:

1

topoDiameter:

2

TopoPSA:

62.23
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Fungicide-likeness scores


The higher the score, the better the fungicide-likeness

RDL:

3.511

QEF:

0.387

Gau:

4.53743