(2,2-Dimethylpentan-3-yl)hydrazine--hydrogen chloride (1/1)

CAS Number: 740799-94-4
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CCC(C(C)(C)C)NN.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HCl.C7H18N2
Molecular Weight
130.234
Drug-likeness
-6.8675
CAS
740799-94-4
InChI key
ZEEYQTUBPHBPEK-RGMNGODLSA-N
SMILES
CCC(C(C)(C)C)NN.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 740799-94-4
Molecule Name (2,2-Dimethylpentan-3-yl)hydrazine--hydrogen chloride (1/1)
Molecular Formula HCl.C7H18N2
SMILES CCC(C(C)(C)C)NN.Cl
InChI InChI=1S/C7H18N2.ClH/c1-5-6(9-8)7(2,3)4;/h6,9H,5,8H2,1-4H3;1H/t6-;/m0./s1
InChI Key ZEEYQTUBPHBPEK-RGMNGODLSA-N
CanonicalSyTyLFy 51a3d52cc6346241
TotalMolweight 166.695
Molecular Weight 130.234
MonoisotopicMass 130.146998
CLogP 0.9408
CLogS -2.085
H Acceptors 2
H Donors 2
TotalSurfaceArea 119.19
Relative PSA 0.22426
PolarSurfaceArea 38.05
Drug-likeness -6.8675
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.55556
Molecula Flexibility 0.70086
Molecular Complexity 0.48648
Fragments 2
Non HAtoms 9
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 3
Sp3Atoms 9
Symmetricatoms 2
StereoCon racemate

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