5-amino-2-hydroxybenzoic acid

C7H7NO3 — CID 4075

IUPAC5-amino-2-hydroxybenzoic acid
SMILESNc1ccc(O)c(C(=O)O)c1
InChIInChI=1S/C7H7NO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,8H2,(H,10,11)
InChIKeyKBOPZPXVLCULAV-UHFFFAOYSA-N
MW153.14 g/mol
LogP0.67
Rot. Bonds1

About 5-amino-2-hydroxybenzoic acid

5-amino-2-hydroxybenzoic acid (PubChem CID 4075) has the molecular formula C7H7NO3 and a molecular weight of 153.14 g/mol. Its IUPAC name is 5-amino-2-hydroxybenzoic acid.

Molecular Properties

Compound Name5-amino-2-hydroxybenzoic acid
PubChem CID4075
Molecular FormulaC7H7NO3
Molecular Weight153.14 g/mol
Exact Mass153.04
IUPAC Name5-amino-2-hydroxybenzoic acid
SMILESNc1ccc(O)c(C(=O)O)c1
InChIInChI=1S/C7H7NO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,8H2,(H,10,11)
InChIKeyKBOPZPXVLCULAV-UHFFFAOYSA-N
XLogP0.67
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

4-Aminosalicylic Acid
CID 4649
Aminosalicylate sodium anhydrous
CID 2724368
3-Aminobenzoic Acid
CID 7419
Aminosalicylate Sodium
CID 16211148
p-Aminosalicylic Acid Monopotassium Salt
CID 23690428
Olsalazine
CID 22419
N-Acetyl-5-Aminosalicylic Acid
CID 65512
5-Nitrosalicylaldehyde
CID 66808
5-Nitrosalicylic acid
CID 7318
Mordant Orange 1
CID 15588
Mesalamine Hydrochloride
CID 201587
3-Amino-4-hydroxybenzoic acid
CID 65083

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-hydroxybenzoic acid?
The IUPAC name of 5-amino-2-hydroxybenzoic acid (CID 4075) is 5-amino-2-hydroxybenzoic acid.
What is the SMILES notation for 5-amino-2-hydroxybenzoic acid?
The canonical SMILES for 5-amino-2-hydroxybenzoic acid is Nc1ccc(O)c(C(=O)O)c1.
What is the InChIKey of 5-amino-2-hydroxybenzoic acid?
The InChIKey is KBOPZPXVLCULAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,8H2,(H,10,11).
What are the key properties of 5-amino-2-hydroxybenzoic acid?
5-amino-2-hydroxybenzoic acid has a molecular weight of 153.14 g/mol, XLogP of 0.67, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-hydroxybenzoic acid is sourced from PubChem (CID 4075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).