1-hydrazinylethanol;nitric acid

C2H9N3O4 — CID 87726706

IUPAC1-hydrazinylethanol;nitric acid
SMILESCC(O)NN.O=[N+]([O-])O
InChIInChI=1S/C2H8N2O.HNO3/c1-2(5)4-3;2-1(3)4/h2,4-5H,3H2,1H3;(H,2,3,4)
InChIKeyKJQZTFNYEQRTPV-UHFFFAOYSA-N
MW139.11 g/mol
LogP-1.56
Rot. Bonds1

About 1-hydrazinylethanol;nitric acid

1-hydrazinylethanol;nitric acid (PubChem CID 87726706) has the molecular formula C2H9N3O4 and a molecular weight of 139.11 g/mol. Its IUPAC name is 1-hydrazinylethanol;nitric acid.

Molecular Properties

Compound Name1-hydrazinylethanol;nitric acid
PubChem CID87726706
Molecular FormulaC2H9N3O4
Molecular Weight139.11 g/mol
Exact Mass139.06
IUPAC Name1-hydrazinylethanol;nitric acid
SMILESCC(O)NN.O=[N+]([O-])O
InChIInChI=1S/C2H8N2O.HNO3/c1-2(5)4-3;2-1(3)4/h2,4-5H,3H2,1H3;(H,2,3,4)
InChIKeyKJQZTFNYEQRTPV-UHFFFAOYSA-N
XLogP-1.56
TPSA121.65 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.11
LogP ≤ 5-1.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 173099484
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2-methylbutane;nitric acid
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CID 87244389
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Frequently Asked Questions

What is the IUPAC name of 1-hydrazinylethanol;nitric acid?
The IUPAC name of 1-hydrazinylethanol;nitric acid (CID 87726706) is 1-hydrazinylethanol;nitric acid.
What is the SMILES notation for 1-hydrazinylethanol;nitric acid?
The canonical SMILES for 1-hydrazinylethanol;nitric acid is CC(O)NN.O=[N+]([O-])O.
What is the InChIKey of 1-hydrazinylethanol;nitric acid?
The InChIKey is KJQZTFNYEQRTPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2O.HNO3/c1-2(5)4-3;2-1(3)4/h2,4-5H,3H2,1H3;(H,2,3,4).
What are the key properties of 1-hydrazinylethanol;nitric acid?
1-hydrazinylethanol;nitric acid has a molecular weight of 139.11 g/mol, XLogP of -1.56, 1 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinylethanol;nitric acid is sourced from PubChem (CID 87726706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).