Grundinformationen
- Standard-SMILES
O=C1OC(=O)c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)OC5=O- InChIKey
CLYVDMAATCIVBF-UHFFFAOYSA-N- Summenformel
- C24H8O6
- Durchschnittliche Molmasse
- 392,3 g/mol
- Monoisotopische Masse
- 392,03208797
Namen und Bezeichner
- Bevorzugter Name
- 3,4,9,10-Perylenetetracarboxylic dianhydride
- IUPAC
- 7,18-dioxaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
- Lokaler Name
- Perylen-3,4:9,10-tetracarbonsaeuredianhydrid
- Englischer Name
- 3,4,9,10-Perylenetetracarboxylic dianhydride
- Summenformel
- C24H8O6
- Molmasse
- 392.32
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
128-69-8- PubChem CID
- 67191
- DTXSID
DTXSID1059577- UNII
- NH27FW2PET
- EC Number
- 204-905-3
- Nikkaji
- J22A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,5
- Polarare Oberfläche (TPSA)
- 86,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 30
- Formalladung
- 0
- Komplexität
- 730
Experimentelle und physikochemische Eigenschaften
Physical Description
CBI
Dark red powder; [Sigma-Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 300 °C · >300 °C(lit.)
- Siedepunkt
- 477.07 °C · 477.07°C (rough estimate)
- Dichte
- 1.3306 · 1.3306 (rough estimate)
- Brechungsindex
- 1.52 · 1.5200 (estimate)
- Flammpunkt
- 400 °C · >400°C
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- 0.87 g/l · 0.87g/l
- Aggregatzustand
- Powder
- Farbe
- Dark red
- PH
- 6 · 6-7 (1g/l, H2O, 20℃)
- Wasserlöslichkeit
- insoluble
- BRN
- 57831 · 57831
- InChI
- 1S/C24H8O6/c25-21-13-5-1-9-10-2-6-15-20-16(24(28)30-23(15)27)8-4-12(18(10)20)11-3-7-14(22(26)29-21)19(13)17(9)11/h1-8H
- InChIKey
- CLYVDMAATCIVBF-UHFFFAOYSA-N
- SMILES
- O1C(=O)c2c3c4c(c5c6c(c4cc2)ccc7c6c(cc5)C(=O)OC7=O)ccc3C1=O
- CAS Datenbank
- 128 · 128-69-8(CAS DataBase Reference)
- NIST chemische Informationen
- 3 · 3,4,9,10-Perylenetetracarboxylic dianhydride(128-69-8)
- EPA chemische Informationen
- 3 · Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone (128-69-8)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 74.1% (160 of 216) of all reports.
Warning
H315 (24.1%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (24.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (23.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 216 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 160 of 216 reports by companies.;There are 6 notifications provided by 56 of 216 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Chemical: Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone 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)
Status: Active Update: 12-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11837;Status: Active Update: 25-10-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/12592
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone: Does not have an individual approval but may be used under an appropriate group standard
Regulatorische Informationen
Regulatory Information
Chemical: Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone 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)
Status: Active Update: 12-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11837;Status: Active Update: 25-10-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/12592
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- F
- 10-21
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29173980
- risk_code
- 36/37/38
- Toxizität
- LD50 orally in Rabbit: > 10000 mg/kg
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Plastics Product Manufacturing;Paint and Coating Manufacturing
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone: ACTIVE
Anwendungen
Verwenden3,4,9,10-Perylenetetracarboxylic dianhydride is an important raw material and intermediate used in organic synthesis, pharmaceuticals and agrochemicals. It is mainly used in air dried and baking enamels, epoxy, polyurethane and polyester based paints. It is also used in printing inks for bank and security documents.
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