Ethyl 2-hydrazinylpropanoate--hydrogen chloride (1/1)

CAS Number: 24292-02-2
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CCOC(C(C)NN)=O.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HCl.C5H12N2O2
Molecular Weight
132.162
Drug-likeness
-7.2502
CAS
24292-02-2
InChI key
JCXYGMSGSQLAHF-WCCKRBBISA-N
SMILES
CCOC(C(C)NN)=O.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 24292-02-2
Molecule Name Ethyl 2-hydrazinylpropanoate--hydrogen chloride (1/1)
Molecular Formula HCl.C5H12N2O2
SMILES CCOC(C(C)NN)=O.Cl
InChI InChI=1S/C5H12N2O2.ClH/c1-3-9-5(8)4(2)7-6;/h4,7H,3,6H2,1-2H3;1H/t4-;/m0./s1
InChI Key JCXYGMSGSQLAHF-WCCKRBBISA-N
CanonicalSyTyLFy a9476f55cb302302
TotalMolweight 168.623
Molecular Weight 132.162
MonoisotopicMass 132.089878
CLogP -1.1942
CLogS -1.111
H Acceptors 4
H Donors 2
TotalSurfaceArea 112.01
Relative PSA 0.44434
PolarSurfaceArea 64.35
Drug-likeness -7.2502
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.77778
Molecula Flexibility 0.65479
Molecular Complexity 0.62123
Fragments 2
Non HAtoms 9
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 4
Sp3Atoms 7
StereoCon racemate

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