Basic information
- CAS
119-28-8- Standard SMILES
Nc1cccc2ccc(S(=O)(=O)O)cc12- InChIKey
QEZZCWMQXHXAFG-UHFFFAOYSA-N- Molecular formula
- C10H9NO3S
- Average molar mass
- 223.25 g/mol
- Monoisotopic mass
- 223.03031415
Overview
determination of nitrite formation from nitrate by bacteria
Names & identifiers
- Preferred name
- Cleve's acid
- IUPAC
- 8-aminonaphthalene-2-sulfonic acid
- English name
- 1-Naphthylamine-7-sulfonic acid
- Molecular formula
- C10H9NO3S
- Molecular weight
- 223.25
Names & synonyms
Show more names
Database identifiers
- CAS
119-28-8- PubChem CID
- 8386
- DTXSID
DTXSID7059486- ChEMBL
CHEMBL4165941- UNII
- 21QEG50798
- EC Number
- 204-311-4
- Nikkaji
- J5.312K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 322
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 300 °C · ≥300 °C(lit.)
- Boiling point
- 220 °C · 220°C (rough estimate)
- Density
- 1.3588 · 1.3588 (rough estimate)
- refractive index
- 1.65 · 1.6500 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Aqueous Base (Slightly), DMSO (Slightly, Sonicated)
- form
- Powder
- pka
- 1 · pK1: 3.66 (25°C)
- Appearance
- Gray to brown Solid
- Merck
- 14 · 14,2351
- BRN
- 2115629 · 2115629
- InChI
- InChI=1S/C10H9NO3S/c11-10-3-1-2-7-4-5-8(6-9(7)10)15(12,13)14/h1-6H,11H2,(H,12,13,14)
- InChIKey
- QEZZCWMQXHXAFG-UHFFFAOYSA-N
- SMILES
- C1=C2C(C=CC=C2N)=CC=C1S(O)(=O)=O
- CAS DataBase Reference
- 119 · 119-28-8(CAS DataBase Reference)
- FDA UNII
- 21 QEG50798 · 21QEG50798
- NIST Chemistry Reference
- 1 · 1-Naphthylamine-7-sulfonic acid(119-28-8)
- EPA Substance Registry System
- 2 · 2-Naphthalenesulfonic acid, 8-amino- (119-28-8)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
- PPE
- 3 · Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2585 · UN 2585 8/PG 3
- WGK Germany
- 2 · 2
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 29214500 · 29214500
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 2 · Skin Irrit. 2
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 3.9% (2 of 51) of reports.
Danger
H314 (86.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 6 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 2-Naphthalenesulfonic acid, 8-amino-
Status: Active Update: 22-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/20714
2-Naphthalenesulfonic acid, 8-amino-: Does not have an individual approval but may be used under an appropriate group standard
Toxicology
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 2
- tsca
- TSCA listed
- ridadr
- UN 2585 8/PG 3
- hs_code
- 29214500
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
- packing_group
- III
- Hazard statements
- H314
- REACH Registrations
- Active
- Hazard Classifications
- Skin Irrit. 2
- Precautionary statements
- P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
Chemistry & industry
Uses & manufacturing
Applications
UsesIntermediate of dyestuff
Uses8-Amino-2-naphthalenesulfonic acid can be used as a reactant to synthesize: Fe3O4/sulfonated polyaniline composite material via chemical oxidative polymerization with aniline in the presence of magnetite (Fe3O4) nanoparticles. Prismatic crystals of strychnine-8-ammonio-2-naphthalenesulfonate-water by heating with strychnine in water/ethanol solvent mixture.5-amino-9-dialkylamino benzo[a]phenoxazine dyes (Nile blue analogs) by condensation with N-alkyl or N-sulfo-propyl 4-arylazo-substituted 3-hydroxyaniline.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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