Grundinformationen
- Standard-SMILES
Cc1ccc(Nc2cc(C(=O)O)c(Nc3ccc(C)cc3)cc2C(=O)O)cc1- InChIKey
FVLUGNOOEZYDNV-UHFFFAOYSA-N- Summenformel
- C22H20N2O4
- Durchschnittliche Molmasse
- 376,4 g/mol
- Monoisotopische Masse
- 376,14230712
Namen und Bezeichner
- Bevorzugter Name
- 2,5-Di-p-toluidinoterephthalic acid
- IUPAC
- 2,5-bis(4-methylanilino)terephthalic acid
- Lokaler Name
- 2,5-Bis(p-toluidino)terephthalsure
- Englischer Name
- Dimethyldianilinoterephthalic acid
- Summenformel
- C22H20N2O4
- Molmasse
- 376.41
Namen und Synonyme
2,5-Di-p-toluidinoterephthalic acid2,5-Bis(p-toluidino)terephthalic acid2,5-bis(4-methylanilino)terephthalic acid2,5-Bis(4-toluidino)terephthalic acidEINECS 233-651-6Terephthalic acid, 2,5-di-p-toluidino-NSC 3199975ZI978ES5L1,4-Benzenedicarboxylic acid, 2,5-bis((4-methylphenyl)amino)-NSC-319997UNII-5ZI978ES5LDTXSID4065024
Weitere Namen anzeigen
Dimethyldianilinoterephthalic acid2,5-di-p-Toluidinoterephthalicacid2,5-Bis(p-toluidino)terephthalsure2,5-Di(4-methylphenylamino)-1,4-benzenedicarboxylic acid2,5-bis[(4-methylphenyl)amino]-4-benzenedicarboxylicacid4-Benzenedicarboxylicacid,2,5-bis[(4-methylphenyl)amino]-1
2,5-BIS(P-TOLYLAMINO)TEREPHTHALIC ACIDEC 233-651-62,5-bis((4-methylphenyl)amino)terephthalic acid2,5-DI-4'-TOLUIDINOTEREPHTHALIC ACIDTOLUIDINOTEREPHTHALIC ACID, 2,5-DI-P-1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-2,5-BIS((4-METHYLPHENYL)AMINO)-1,4-BENZENEDICARBOXYLIC ACID2,5-bis{(4-methylphenyl)amino}terephthalic acid
Datenbank-Bezeichner
- CAS
10291-28-8- PubChem CID
- 82524
- DTXSID
DTXSID4065024- UNII
- 5ZI978ES5L
- EC Number
- 233-651-6
- Nikkaji
- J180.896F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,9
- Polarare Oberfläche (TPSA)
- 98,7 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 491
Experimentelle und physikochemische Eigenschaften
Physical DescriptionCBI
Physikochemische Eigenschaften
- Schmelzpunkt
- 334 °C · 334 °C
- Siedepunkt
- 584.484 · 584.484±50.00 °C(Press: 760.00 Torr)(predicted)
- Dichte
- 1.349 · 1.349±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- Aggregatzustand
- Powder
- pka
- 3.121 · 3.121±0.36(predicted)
- LogP
- 1.73 at · 1.73 at 23℃
- EPA chemische Informationen
- 2 · 2,5-Di-p-toluidinoterephthalic acid (10291-28-8)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.
Not Classified
Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-
1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]- 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: 18-10-2011 https://echa.europa.eu/registration-dossier/-/registered-dossier/1193
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 550,000 - <1,000,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Synthetic Dye and Pigment Manufacturing
1,4-Benzenedicarboxylic acid, 2,5-bis[(4-methylphenyl)amino]-: ACTIVE
Anbieter2 Anbieter
南京新瑞医药科技有限公司19850079587 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
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