acetic acid;azane;phosphoric acid;zinc

C2H10NO6PZn — CID 174918986

IUPACacetic acid;azane;phosphoric acid;zinc
SMILESCC(=O)O.N.O=P(O)(O)O.[Zn]
InChIInChI=1S/C2H4O2.H3N.H3O4P.Zn/c1-2(3)4;;1-5(2,3)4;/h1H3,(H,3,4);1H3;(H3,1,2,3,4);
InChIKeyKKZAILJUGSHSHX-UHFFFAOYSA-N
MW240.47 g/mol
LogP-0.68
Rot. Bonds

About acetic acid;azane;phosphoric acid;zinc

acetic acid;azane;phosphoric acid;zinc (PubChem CID 174918986) has the molecular formula C2H10NO6PZn and a molecular weight of 240.47 g/mol. Its IUPAC name is acetic acid;azane;phosphoric acid;zinc.

Molecular Properties

Compound Nameacetic acid;azane;phosphoric acid;zinc
PubChem CID174918986
Molecular FormulaC2H10NO6PZn
Molecular Weight240.47 g/mol
Exact Mass238.95
IUPAC Nameacetic acid;azane;phosphoric acid;zinc
SMILESCC(=O)O.N.O=P(O)(O)O.[Zn]
InChIInChI=1S/C2H4O2.H3N.H3O4P.Zn/c1-2(3)4;;1-5(2,3)4;/h1H3,(H,3,4);1H3;(H3,1,2,3,4);
InChIKeyKKZAILJUGSHSHX-UHFFFAOYSA-N
XLogP-0.68
TPSA150.06 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.47
LogP ≤ 5-0.68
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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CID 87603832
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CID 161248313
acetic acid;azane
CID 173340275
acetic acid;phosphoric acid;propanoic acid
CID 162090044
acetic acid;phosphono dihydrogen phosphate;phosphoric acid
CID 88733603
methanol;phosphoric acid;propan-2-one
CID 134563724
calcium;acetic acid;hydrogen phosphate
CID 155194224
potassium;azane;phosphoric acid;acetate
CID 175960503
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CID 173017451

Frequently Asked Questions

What is the IUPAC name of acetic acid;azane;phosphoric acid;zinc?
The IUPAC name of acetic acid;azane;phosphoric acid;zinc (CID 174918986) is acetic acid;azane;phosphoric acid;zinc.
What is the SMILES notation for acetic acid;azane;phosphoric acid;zinc?
The canonical SMILES for acetic acid;azane;phosphoric acid;zinc is CC(=O)O.N.O=P(O)(O)O.[Zn].
What is the InChIKey of acetic acid;azane;phosphoric acid;zinc?
The InChIKey is KKZAILJUGSHSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.H3N.H3O4P.Zn/c1-2(3)4;;1-5(2,3)4;/h1H3,(H,3,4);1H3;(H3,1,2,3,4);.
What are the key properties of acetic acid;azane;phosphoric acid;zinc?
acetic acid;azane;phosphoric acid;zinc has a molecular weight of 240.47 g/mol, XLogP of -0.68, 0 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;azane;phosphoric acid;zinc is sourced from PubChem (CID 174918986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).