2-hydroxybenzoic acid;nitrous acid

C7H7NO5 — CID 157117402

IUPAC2-hydroxybenzoic acid;nitrous acid
SMILESO=C(O)c1ccccc1O.O=NO
InChIInChI=1S/C7H6O3.HNO2/c8-6-4-2-1-3-5(6)7(9)10;2-1-3/h1-4,8H,(H,9,10);(H,2,3)
InChIKeyAHOKOBNRKKASNY-UHFFFAOYSA-N
MW185.14 g/mol
LogP1.23
Rot. Bonds1

About 2-hydroxybenzoic acid;nitrous acid

2-hydroxybenzoic acid;nitrous acid (PubChem CID 157117402) has the molecular formula C7H7NO5 and a molecular weight of 185.14 g/mol. Its IUPAC name is 2-hydroxybenzoic acid;nitrous acid.

Molecular Properties

Compound Name2-hydroxybenzoic acid;nitrous acid
PubChem CID157117402
Molecular FormulaC7H7NO5
Molecular Weight185.14 g/mol
Exact Mass185.03
IUPAC Name2-hydroxybenzoic acid;nitrous acid
SMILESO=C(O)c1ccccc1O.O=NO
InChIInChI=1S/C7H6O3.HNO2/c8-6-4-2-1-3-5(6)7(9)10;2-1-3/h1-4,8H,(H,9,10);(H,2,3)
InChIKeyAHOKOBNRKKASNY-UHFFFAOYSA-N
XLogP1.23
TPSA107.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.14
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

arsorous acid;azane;2-hydroxybenzoic acid;nitrous acid;platinum(4+)
CID 11706542
2-hydroxybenzoic acid;praseodymium
CID 87786006
CID 87183669
CID 87183669
2-hydroxybenzoic acid;hydrobromide
CID 70122828
gadolinium;tris(2-hydroxybenzoic acid)
CID 135122115
chromium;2-hydroxybenzoic acid
CID 87079476
2-hydroxybenzoic acid;bis(yttrium)
CID 20697161
bis(2-hydroxybenzoic acid);sulfane
CID 172742301
2-hydroxybenzoic acid;silver
CID 87326670
strontium;hydride;2-hydroxybenzoic acid
CID 172999910
2-hydroxybenzoic acid;hypochlorous acid
CID 68579561
azanide;2-hydroxybenzoic acid;platinum(2+)
CID 59733827

Frequently Asked Questions

What is the IUPAC name of 2-hydroxybenzoic acid;nitrous acid?
The IUPAC name of 2-hydroxybenzoic acid;nitrous acid (CID 157117402) is 2-hydroxybenzoic acid;nitrous acid.
What is the SMILES notation for 2-hydroxybenzoic acid;nitrous acid?
The canonical SMILES for 2-hydroxybenzoic acid;nitrous acid is O=C(O)c1ccccc1O.O=NO.
What is the InChIKey of 2-hydroxybenzoic acid;nitrous acid?
The InChIKey is AHOKOBNRKKASNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O3.HNO2/c8-6-4-2-1-3-5(6)7(9)10;2-1-3/h1-4,8H,(H,9,10);(H,2,3).
What are the key properties of 2-hydroxybenzoic acid;nitrous acid?
2-hydroxybenzoic acid;nitrous acid has a molecular weight of 185.14 g/mol, XLogP of 1.23, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxybenzoic acid;nitrous acid is sourced from PubChem (CID 157117402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).