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Tetrasodium 1,3,6,8-pyrenetetrasulfonate

HCID 101082
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
59572-10-0
Standard SMILES
O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43.[Na+].[Na+].[Na+].[Na+]
InChIKey
UZBIRLJMURQVMX-UHFFFAOYSA-J
Molecular formula
C16H6Na4O12S4
Average molar mass
610.4 g/mol
Monoisotopic mass
609.8332874

Names & identifiers

Preferred name
Tetrasodium 1,3,6,8-pyrenetetrasulfonate
IUPAC
tetrasodium;pyrene-1,3,6,8-tetrasulfonate
English name
1,3,6,8-Pyrenetetrasulfonic acid tetrasodium salt
Molecular formula
C16H11NaO12S4
Molecular weight
546.48

Names & synonyms

59572-10-0Tetrasodium 1,3,6,8-pyrenetetrasulfonateTrasar 23299DTXSID90412331,3,6,8-Pyrenetetrasulfonic acid, sodium salt (1:4)UNII-P062LD4V71DTXCID7021233P062LD4V711,3,6,8-TETRASODIUM PYRENETETRASULFONATERefChem:1888761,3,6,8-pyrenetetrasulfonic acid tetrasodium saltSodium pyrene-1,3,6,8-tetrasulfonate
Show more names
PTAS1,3,6,8-Pyrenetetrasulfonic acid tetrasodium salt hydratePTSA98JACS-59572-10-0pyrenetetrasulfonate1,3,6,8-PyrenetetrasuLfluorescent tracer PTSAfonic acid tetrasodium saLPYRENE-1,3,6,8-TETRASULFONATE1,3,6,8-pyrenetetrasulfonic acid
1,3,6,8-Pyrenetetrasulfonic acid, tetrasodium salttetrasodium;pyrene-1,3,6,8-tetrasulfonateC16H6Na4O12S4Pyrene-tetrasodium pyrene-1,3,6,8-tetrasulfonateMFCD00042029PERFLUOROOCTANOYLFLUORIDEPyrene-1,3,6,8-tetrasulfonic acid tetrasodium

Properties

Computed structural properties

Topological polar surface area
262 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
12
Rotatable bonds
0
Heavy atoms
36
Formal charge
0
Complexity
942

Experimental & physicochemical properties

Physical DescriptionWet Solid

Physicochemical properties

Boiling point
337 · 337-466℃
Density
2.015 · 2.015-2.15
vapor pressure
0 Pa · 0Pa at 25℃
storage temp.
Inert atmosphere,Room Temperature
solubility
Soluble in water
form
Fine Crystalline Powder
color
Green
λmax
374 nm · 374nm (H2O)
BRN
3646090 · 3646090
Major Application
Assessing interaction between sulfonated polystyrene and poly(ethylacrylate-co4-vinylpyridine) ionomers;20 carbon nanotube;21 evaluating/studying influence of incorporation of counterions into polypyrrole; examining salt group association of sulfonated polystyrene ionomers; fabricating graphene-based nanoelectronic devices; graphene/polymer dispersions for graphene/polymer nanocomposites, organic solar cells, conductive films, ink-jet-printed electronic devices; graphene-zeolite based microcapsules; investigating electrical breakdown/permeability control of bilayer-corked capsule membrane; light filters; monitoring wastewater treatment; poly(arylene sulfide) blends in UV weathering; pulp and papermaking processes; thermosensitive polymer gels; thin films; TiO2-based materials; tracing corrosive materials; ureasil gels for water purification

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 · 5 items

This chemical does not meet GHS hazard criteria for 17.5% (10 of 57) of reports.

Warning

H315 (75.4%): 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)

Aggregated GHS information provided per 57 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 4 items

Chemical: 1,3,6,8 - Pyrenetetrasulfonic acid tetra sodium salt

1,3,6,8-Pyrenetetrasulfonic acid, sodium salt (1:4) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3,6,8-Pyrenetetrasulfonic acid, sodium salt (1:4) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

REACH registered substance: 1,3,6,8-Pyrenetetrasulfonic acid, sodium salt (1:4) (EC: 626-424-1)

1,3,6,8-Pyrenetetrasulphonic acid, tetrasodium salt: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (75.4%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
TSCA listed
hs_code
29049090
risk_code
36/37/38
Signal word

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 131,542 lb
Consumer UsesDye
Industry UsesDye
General Manufacturing Information · 2 items

Synthetic Dye and Pigment Manufacturing

1,3,6,8-Pyrenetetrasulfonic acid, sodium salt (1:4): ACTIVE

Applications

UsesFluorescent probe.

Suppliers100 total

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
湖北成丰化工有限公司13125175253 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
湖北云镁科技有限公司027-59206672 18327059871 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

Related reactions

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New reaction record

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
59572-10-0
PubChem CID
101082
DTXSID
DTXSID9041233
UNII
P062LD4V71
EC Number
626-424-1
Nikkaji
J429.391F
Biological Applications
Characterizing water-in-oil-in-water (W/O/W) emulsions; as a substrate for measuring lipase activity; air-breathing biocathodes for zinc/oxygen batteries; graphene-coated biochar for various environmental applications;plants or plant parts identification labels
InChIKey
GQZOIEBZZPMPML-UHFFFAOYSA-N
SMILES
S(C1C=C(S(O)(=O)=O)C2C=CC3C(=CC(S(O)(=O)=O)=C4C=CC=1C=2C=34)S(O)(=O)=O)(O)(=O)=O.[NaH]
LogP
-4.5 · -4.5-0.899 at 20℃ and pH7
CAS DataBase Reference
59572 · 59572-10-0(CAS DataBase Reference)
FDA UNII
62 LD4V71 · P062LD4V71
EPA Substance Registry System
1 · 1,3,6,8-Pyrenetetrasulfonic acid, tetrasodium salt (59572-10-0)
UNSPSC Code
12171500 · 12171500
NACRES
32 · NA.32
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
TSCA
TSCA listed
HS Code
29049090 · 29049090
Storage Class
11 · 11 - Combustible Solids
REACH Registrations
Active
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319-H335
REACH Registrations
Active
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338
Hebei Henghe Import and Export Trading Co. LTD
+8618032935937 18032916000 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海晶抗生物工程有限公司021-54721350 13524668266 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
河北茹麒科技有限公司176-03256889 17603256889 · [email protected]
湖北健楚生物医药有限公司027-65528353 13554206703 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118076; 18086118070 · [email protected]
苏州启航生物科技有限公司18662190603;18151111370 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
Hebei Qige Biological Technology Co. Ltd+86 +8618733132031
北京伊诺凯科技有限公司15652467323 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海石洋化工有限公司021-56795766 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
湖北科易佳化工有限公司15629167229 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
资川生化科技(苏州)有限公司0512-66317708 13372112871 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
湖北川合化工有限公司187-7130-7593 18672969259 · [email protected]
武汉匠信生物科技有限公司19272768272 18007157445 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
苏州棓诺生物有限公司15862318862 · [email protected]
湖北猫尔沃生物医药有限公司[email protected]
湖北昭亿生物科技有限公司13437178871 · [email protected]
安泰精细化工技术有限公司18503026267 · [email protected]
湖北鸿鑫瑞宇精细化工有限公司027-65526929 15102793023 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]