2-(4′-Hydroxyphenylazo)benzoic acid

C₁₃H₁₀N₂O₃CAS 1634-82-8242.23 g/mol

Open in Covalent MOL file

Azo Carboxylic acid Phenol

Properties

Molecular formula: C₁₃H₁₀N₂O₃
Molar mass: 242.23 g/mol
Exact mass: 242.0691 Da
Melting point: 206–207 °C
logP: 3.51Crippen estimate
Polar surface area: 82.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation98.2% of notifiers

Aggregated from 57 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1634-82-8

SMILES

O=C(O)c1ccccc1N=Nc1ccc(O)cc1

InChIKey

DWQOTEPNRWVUDA-UHFFFAOYSA-N

InChI

InChI=1S/C13H10N2O3/c16-10-7-5-9(6-8-10)14-15-12-4-2-1-3-11(12)13(17)18/h1-8,16H,(H,17,18)

Weigh it out

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Names and synonyms

15 names · show all

Benzoic acid, 2-[2-(4-hydroxyphenyl)diazenyl]-
Benzoic acid, o-[(p-hydroxyphenyl)azo]-
Benzoic acid, 2-[(4-hydroxyphenyl)azo]-
2-[2-(4-Hydroxyphenyl)diazenyl]benzoic acid
o-(p-Hydroxyphenylazo)benzoic acid
2-[(4-Hydroxyphenyl)azo]benzoic acid
2-(4-Hydroxybenzeneazo)benzoic acid
HABA
HABA (dye)
4′-Hydroxyazobenzene-2-carboxylic acid
2-(4′-Hydroxybenzeneazo)benzoic acid
4-(2′-Carboxyphenylazo)phenol
NSC 77376
4-Hydroxyazobenzene-2′-carboxylic acid
2-(4-Hydroxyphenylazo)benzoic acid

Work with 2-(4′-Hydroxyphenylazo)benzoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl red493-52-766 % similar Ethyl red76058-33-863 % similar 2-[2-[4-(Dipropylamino)phenyl]diazenyl]benzoic acid2641-01-259 % similar Dihydroavenanthramide D697235-49-757 % similar Diazenylbenzoic acid58434-28-953 % similar 2-(4-Hydroxybenzoyl)benzoic acid85-57-453 % similar p-Phenylazobenzoic acid1562-93-250 % similar Solvent yellow 71689-82-350 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-5-nitrobenzophenone1775-95-7 4-Amino-3-nitrobenzophenone31431-19-3 4′-Nitrobenzanilide3393-96-2 2′-Nitrobenzanilide728-90-5

Elsewhere

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