(1-Hydrazinylethyl)phosphonic acid

CAS Number: 60347-07-1
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CC(NN)P(O)(O)=O
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
C2H9N2O3P
Molecular Weight
140.078
Drug-likeness
-17.378
CAS
60347-07-1
InChI key
SEWYBHGROIXQMZ-REOHCLBHSA-N
SMILES
CC(NN)P(O)(O)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 60347-07-1
Molecule Name (1-Hydrazinylethyl)phosphonic acid
Molecular Formula C2H9N2O3P
SMILES CC(NN)P(O)(O)=O
InChI InChI=1S/C2H9N2O3P/c1-2(4-3)8(5,6)7/h2,4H,3H2,1H3,(H2,5,6,7)/t2-/m0/s1
InChI Key SEWYBHGROIXQMZ-REOHCLBHSA-N
CanonicalSyTyLFy 12092d7c223f59
TotalMolweight 140.078
Molecular Weight 140.078
MonoisotopicMass 140.03508
CLogP -4.9012
CLogS 0.187
H Acceptors 5
H Donors 4
TotalSurfaceArea 94.71
Relative PSA 0.73857
PolarSurfaceArea 105.39
Drug-likeness -17.378
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.625
Molecula Flexibility 0.4391
Molecular Complexity 0.8283
Fragments 1
Non HAtoms 8
NonCHAtoms 6
Electronegative Atoms 6
StereoCenters 1
Rotatable Bond 2
Sp3Atoms 7
Symmetricatoms 1
AcidicOxygens 2
StereoCon racemate

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