6-Amino-2-naphthalenesulfonic acid

C10H9NO3SCAS 93-00-5223.25 g/mol

Open in Covalent MOL file
H2NSOOOH
Primary amineSulfonic acid

Properties

Molecular formula
C10H9NO3S
Molar mass
223.25 g/mol
Exact mass
223.0303 Da
logP
1.67Crippen estimate
Polar surface area
80.4 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 178 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, P501

Identifiers

CAS number
93-00-5
SMILES
Nc1ccc2cc(S(=O)(=O)O)ccc2c1
InChIKey
SEMRCUIXRUXGJX-UHFFFAOYSA-N
InChI
InChI=1S/C10H9NO3S/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9/h1-6H,11H2,(H,12,13,14)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all
  • 2-Naphthalenesulfonic acid, 6-amino-
  • Broenner's acid
  • Bronner acid
  • Bronner's acid
  • 2-Naphthylamine-6-sulfonic acid
  • 6-Naphthylamine-2-sulfonic acid
  • Phenamine fast scarlet 4BGP
  • Pontamine fast scarlet 4BA
  • 2-Amino-6-sulfonaphthalene
  • 2-Amino-6-naphthalenesulfonic acid
  • 2-Amino-6-naphthylsulfonic acid
  • 6-Sulfo-2-naphthylamine
  • Amino-Schaeffer acid
  • NSC 31511
  • NSC 4985
  • 2-Naphthylamino-6-sulfonic acid

Work with 6-Amino-2-naphthalenesulfonic 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

2,6-Naphthalenedisulfonic acid581-75-974 % similar Sulfanilic acid121-57-366 % similar 2,7-Naphthalenedisulfonic acid92-41-166 % similar Naphthalene-2-sulfonic acid120-18-365 % similar 6-Amino-1,3-naphthalenedisulfonic acid118-33-264 % similar 7-Amino-1,3-naphthalenedisulfonic acid86-65-764 % similar Metanilic acid121-47-163 % similar 7-Amino-4-hydroxy-2-naphthalenesulfonic acid87-02-562 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

8-Amino-2-naphthalenesulfonic acid119-28-8 5-Amino-2-naphthalenesulfonic acid119-79-9 Methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate188614-01-9 Probenazole27605-76-1 5-(4-Hydroxybenzyl)thiazolidine-2,4-dione74772-78-4 6-Aminonaphthalene-1-sulphonic acid81-05-0 Tobias acid81-16-3 Peri acid82-75-7

Elsewhere

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