1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]-
Grundinformationen
- CAS
119344-86-4- Standard-SMILES
CCC(Cc1ccc(C)cc1)(C(=O)c1ccc(N2CCOCC2)cc1)N(C)C- InChIKey
PUBNJSZGANKUGX-UHFFFAOYSA-N- Summenformel
- C24H32N2O2
- Durchschnittliche Molmasse
- 380,5 g/mol
- Monoisotopische Masse
- 380,24637826
Überblick
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Namen und Bezeichner
- Bevorzugter Name
- 1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]-
- IUPAC
- 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-(4-morpholin-4-ylphenyl)butan-1-one
- Englischer Name
- PI379
- Summenformel
- C24H32N2O2
- Molmasse
- 380.52
Namen und Synonyme
1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]-DTXSID308696272-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(morpholin-4-yl)phenyl]butan-1-one1-Butanone, 2-(dimethylamino)-2-((4-methylphenyl)methyl)-1-(4-(4-morpholinyl)phenyl)-2-(dimethylamino)-2-((4-methylphenyl)methyl)-1-(4-(morpholin-4-yl)phenyl)butan-1-oneRefChem:430920DTXCID10817585438-340-0119344-86-42-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-(4-morpholin-4-ylphenyl)butan-1-oneMFCD280108672-(4-methylbenzyl)-2-(dimethylamino)-1-(4-morpholinophenyl)butan-1-one
Weitere Namen anzeigen
2-Dimethylamino-2-(4-methyl-benzyl)-1-(4-morpholin-4-yl-phenyl)-butan-1-oneIrgacure 379Photoinitiator-379PI 379YF-PI 379IHT-PI 379OMNIRAD 379Omnirad 930Keycure 8179
2-(Dimethylamino)-2-(4-methylbenZyl)-1-(4-morpholinophenyl)butan-1-one2-(Dimethylamino)-2-(4-methylbenzyl)-1-[(4-morpholin-4-yl)phenyl]-1-butanone2-(DIMETHYLAMINO)-2-[(4-METHYLPHENYL)METHYL]-1-[4-(4-MORPHOLINYL)PHENYL]-1-BUTANONEPhotoinitiator379SCHEMBL58161MSK177814MSK177814-100AMSK177814-1000A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,5
- Polarare Oberfläche (TPSA)
- 32,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 487
Experimentelle und physikochemische Eigenschaften
Physical DescriptionCBI; Large Crystals; Other Solid; Dry Powder; Liquid
Physikochemische Eigenschaften
- Siedepunkt
- 542 · 542.0±50.0 °C(Predicted)
- Dichte
- 1.083 · 1.083
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- storage temp.
- 2 · 2-8°C, protect from light
- Löslichkeit
- 2.75 in · 2.75 in mg/100g standard fat at 20 ℃
- pka
- 6.74 · 6.74±0.50(Predicted)
- Wasserlöslichkeit
- 1.9 mg/L · 1.9mg/L at 20℃
- InChI
- InChI=1S/C24H32N2O2/c1-5-24(25(3)4,18-20-8-6-19(2)7-9-20)23(27)21-10-12-22(13-11-21)26-14-16-28-17-15-26/h6-13H,5,14-18H2,1-4H3
- InChIKey
- PUBNJSZGANKUGX-UHFFFAOYSA-N
- SMILES
- C(C1=CC=C(N2CCOCC2)C=C1)(=O)C(N(C)C)(CC1=CC=C(C)C=C1)CC
- LogP
- 4.1 at · 4.1 at 25℃
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H360Df: May damage the unborn child; Suspected of damaging fertility [Danger Reproductive toxicity]
P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)
Warning
H361 (65.6%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]
P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)
Gefahrenhinweise
Regulatory Information
Chemical: 1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]-
Hazard Traits - Reproductive Toxicity
1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]- 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 09-02-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/15616
Substance: 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(morpholin-4-yl)phenyl]butan-1-one
Hazard Classes and Categories
Repr. 2 (65.6%)
Reproductive toxicity - Category 1B
Repr. 1B
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 2934999090
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 100,000 - <250,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Printing and Related Support Activities
1-Butanone, 2-(dimethylamino)-2-[(4-methylphenyl)methyl]-1-[4-(4-morpholinyl)phenyl]-: ACTIVE
Anwendungen
VerwendenPI379 (Photoinitiator379) is a highly efficient ultraviolet (UV) initiator, mainly used in UV curing systems such as inks and coatings.
Zugehörige Reaktionen
2
Notizen zur Verbindung
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