(2-Chloroethyl)phosphonic acid--hydrazine (2/1)

CAS Number: 74968-27-7
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NN.OP(CCCl)(O)=O.OP(CCCl)(O)=O
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
C2H6O3ClP.C2H6O3ClP.H4N2
Molecular Weight
144.494
Drug-likeness
-14.804
CAS
74968-27-7
InChI key
UZXWBAGHVQOXAH-UHFFFAOYSA-N
SMILES
NN.OP(CCCl)(O)=O.OP(CCCl)(O)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: high
PropertyValue
CAS Number 74968-27-7
Molecule Name (2-Chloroethyl)phosphonic acid--hydrazine (2/1)
Molecular Formula C2H6O3ClP.C2H6O3ClP.H4N2
SMILES NN.OP(CCCl)(O)=O.OP(CCCl)(O)=O
InChI InChI=1S/2C2H6ClO3P.H4N2/c2*3-1-2-7(4,5)6;1-2/h2*1-2H2,(H2,4,5,6);1-2H2
InChI Key UZXWBAGHVQOXAH-UHFFFAOYSA-N
CanonicalSyTyLFy b5961c2797db8082
TotalMolweight 321.033
Molecular Weight 144.494
MonoisotopicMass 143.974309
CLogP -2.6491
CLogS -0.23
H Acceptors 3
H Donors 2
TotalSurfaceArea 92.91
Relative PSA 0.46518
PolarSurfaceArea 67.34
Drug-likeness -14.804
Mutagenic low
Tumorigenic high
Reproductive Effective high
Irritant none
Shape Index 0.71429
Molecula Flexibility 0.79615
Molecular Complexity 0.59725
Fragments 3
Non HAtoms 7
NonCHAtoms 5
Electronegative Atoms 5
Rotatable Bond 2
Sp3Atoms 5
Symmetricatoms 1
AcidicOxygens 2

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