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83846-86-0 | 9H-Thioxanthen-9-one,4-(1-methylethyl)-
CAS No: 83846-86-0 Catalog No: AG004S5Y MDL No:MFCD00192247
Product Description
Catalog Number:
AG004S5Y
Chemical Name:
9H-Thioxanthen-9-one,4-(1-methylethyl)-
CAS Number:
83846-86-0
Molecular Formula:
C16H14OS
Molecular Weight:
254.3468
MDL Number:
MFCD00192247
IUPAC Name:
4-propan-2-ylthioxanthen-9-one
InChI:
InChI=1S/C16H14OS/c1-10(2)11-7-5-8-13-15(17)12-6-3-4-9-14(12)18-16(11)13/h3-10H,1-2H3
InChI Key:
IKVYHNPVKUNCJM-UHFFFAOYSA-N
SMILES:
CC(c1cccc2c1sc1ccccc1c2=O)C
EC Number:
281-065-4
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.347g/mol
Monoisotopic Mass:
254.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Endocrine-disrupting effects of thioxanthone photoinitiators. | Toxicological sciences : an official journal of the Society of Toxicology 20130301 |
| The materials challenge in diffraction-unlimited direct-laser-writing optical lithography. | Advanced materials (Deerfield Beach, Fla.) 20100824 |
| Mass transfer ways of ultraviolet printing ink ingredients into foodstuffs. | Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment 20100701 |
| [Chronic toxicity of 97% isopropyl thioxanthone in rat by oral administration for 2 years]. | Zhonghua lao dong wei sheng zhi ye bing za zhi = Zhonghua laodong weisheng zhiyebing zazhi = Chinese journal of industrial hygiene and occupational diseases 20090301 |
| Development of a method to study the migration of six photoinitiators into powdered milk. | Journal of agricultural and food chemistry 20080423 |
| Determination of isopropyl thioxanthone (ITX) in fruit juices by pressurized liquid extraction and liquid chromatography-mass spectrometry. | Journal of agricultural and food chemistry 20061004 |
| Determination of isopropylthioxanthone (ITX) in milk, yoghurt and fat by HPTLC-FLD, HPTLC-ESI/MS and HPTLC-DART/MS. | Analytical and bioanalytical chemistry 20060601 |
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