Naphthalenesulfonic acid, dibutyl-
Basic information
- CAS
25377-92-8- Standard SMILES
CCCCc1cc(CCCC)c2ccccc2c1S(=O)(=O)O- InChIKey
QZEDXQFZACVDJE-UHFFFAOYSA-N- Molecular formula
- C18H24O3S
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.1446158
Names & identifiers
- Preferred name
- Naphthalenesulfonic acid, dibutyl-
- IUPAC
- 2,4-dibutylnaphthalene-1-sulfonic acid
- English name
- dibutylnaphthalenesulphonic acid
- Molecular formula
- C18H24O3S
- Molecular weight
- 320.44636
Names & synonyms
Naphthalenesulfonic acid, dibutyl-25377-92-8EINECS 246-921-3RefChem:164634Dibutylnaphthalenesulphonic acidSCHEMBL11512168JCRNSBKSAQHNIN-UHFFFAOYSA-NDibutylnaphthalinsulfonsureDibutylnaphthalenesulfonic acid
Database identifiers
- CAS
25377-92-8- PubChem CID
- 117461
- EC Number
- 246-921-3
- Nikkaji
- J189.062J
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 426
Physicochemical properties
- EPA Substance Registry System
- Naphthalenesulfonic acid, dibutyl- (25377-92-8)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 290 · H290-H314-H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P234-P390-P404-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H290 (66.7%): May be corrosive to metals [Warning Corrosive to Metals]
P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P332+P317, P362+P364, P363, P390, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Naphthalenesulfonic acid, dibutyl-
Naphthalenesulfonic acid, dibutyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesMet. Corr. 1 (66.7%)
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H290-H314-H318
- Precautionary statements
- P280-P305+P351+P338-P310-P234-P390-P404-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNaphthalenesulfonic acid, dibutyl-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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