Basic information
- CAS
6528-53-6- Standard SMILES
O=S(=O)(O)c1cc(S(=O)(=O)O)c2ccc3c(S(=O)(=O)O)cc(S(=O)(=O)O)c4ccc1c2c43- InChIKey
CZLSHVQVNDDHDQ-UHFFFAOYSA-N- Molecular formula
- C16H10O12S4
- Average molar mass
- 522.5 g/mol
- Monoisotopic mass
- 521.90551044
Names & identifiers
- Preferred name
- 1,3,6,8-Pyrenetetrasulfonic acid
- IUPAC
- pyrene-1,3,6,8-tetrasulfonic acid
- English name
- 1,3,6,8-Pyrenetetrasulphonic acid
- Molecular formula
- C16H10O12S4
- Molecular weight
- 522.5
Names & synonyms
1,3,6,8-Pyrenetetrasulfonic acid6528-53-6Pyrene-1,3,6,8-tetrasulphonic acidDTXSID5044310RefChem:412712DTXCID3024310229-423-0Pyrene-1,3,6,8-Tetrasulfonic Acid1,3,6,8-Pyrenetetrasulphonic acid1,3,6,8-Pyrene tetrasulfonateCEZ11T634XUNII-CEZ11T634X
Show more names
1,3,6,8-Tetrasulfopyrene
EINECS 229-423-0SCHEMBL305044CZLSHVQVNDDHDQ-UHFFFAOYSA-NAT42543LS-14464PD130641NS00035857Q27275426
Database identifiers
- CAS
6528-53-6- PubChem CID
- 81017
- DTXSID
DTXSID5044310- UNII
- CEZ11T634X
- EC Number
- 229-423-0
- Nikkaji
- J225.167A
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 251 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 995
Physicochemical properties
- Density
- 2.064 · 2.064±0.06 g/cm3(Predicted)
- pka
- -1.71 · -1.71±0.30(Predicted)
- FDA UNII
- 11 T634X · CEZ11T634X
- EPA Substance Registry System
- 1 · 1,3,6,8-Pyrenetetrasulfonic acid (6528-53-6)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
- HS Code
- 2904100090 · 2904100090
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2904100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3,6,8-Pyrenetetrasulfonic acid: ACTIVE
Upstream & downstream products
Downstream products
Suppliers4 total
Syntechem Co.,Ltd[email protected]
Alfa Chemistry+1-5166625404 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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