Basic information
- CAS
119344-86-4- Standard SMILES
CCC(Cc1ccc(C)cc1)(C(=O)c1ccc(N2CCOCC2)cc1)N(C)C- InChIKey
PUBNJSZGANKUGX-UHFFFAOYSA-N- Molecular formula
- C24H32N2O2
- Average molar mass
- 380.5 g/mol
- Monoisotopic mass
- 380.24637826
Overview
See other relationships...
Names & identifiers
- Preferred 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
- English name
- PI379
- Molecular formula
- C24H32N2O2
- Molecular weight
- 380.52
Names & synonyms
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
Show more names
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
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 487
Experimental & physicochemical properties
Physical DescriptionCBI; Large Crystals; Other Solid; Dry Powder; Liquid
Physicochemical properties
- Boiling point
- 542 · 542.0±50.0 °C(Predicted)
- Density
- 1.083 · 1.083
- vapor pressure
- 0 Pa · 0Pa at 25℃
- storage temp.
- 2 · 2-8°C, protect from light
- solubility
- 2.75 in · 2.75 in mg/100g standard fat at 20 ℃
- pka
- 6.74 · 6.74±0.50(Predicted)
- Appearance
- White to off-white Solid
- Water Solubility
- 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
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
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)
Hazard information
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
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS08,GHS09
Chemistry & industry
Uses & manufacturing
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
Applications
UsesPI379 (Photoinitiator379) is a highly efficient ultraviolet (UV) initiator, mainly used in UV curing systems such as inks and coatings.
Suppliers100 total
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
Related reactions
2 records
Compound notes
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