60720
Ketone Moschus
≥97.0% (N)
Synonym(s):
4-tert-Butyl-2,6-dimethyl-3,5-dinitroacetophenone, Musk ketone
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About This Item
Empirical Formula (Hill Notation):
C14H18N2O5
CAS Number:
Molecular Weight:
294.30
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
201-328-9
Beilstein/REAXYS Number:
2062638
MDL number:
InChI key
WXCMHFPAUCOJIG-UHFFFAOYSA-N
InChI
1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3
SMILES string
CC(=O)c1c(C)c(c(c(c1C)[N+]([O-])=O)C(C)(C)C)[N+]([O-])=O
assay
≥97.0% (N)
mp
134-137 °C
signalword
Warning
hcodes
Hazard Classifications
Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 2
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
>334.4 °F - closed cup
flash_point_c
> 168 °C - closed cup
ppe
Eyeshields, Gloves, type N95 (US)
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Laurence Roosens et al.
Chemosphere, 69(10), 1540-1547 (2007-07-17)
Synthetic musks, such as 7-acetyl-1,1,3,4,4,6-hexamethyl-1,2,3,4-tetrahydronaphthalene (AHTN) and 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethylcyclopenta-gamma-2-benzopyran (HHCB), musk ketone (MK) and musk xylene (MX), are used as an alternative for natural musk. Due to their widespread use, these synthetic compounds turned up in different environmental compartments, such as
Leah Wollenberger et al.
The Science of the total environment, 305(1-3), 53-64 (2003-04-03)
A nitro musk (musk ketone) and three polycyclic musks (Tonalide, Galaxolide and Celestolide) were tested for acute and subchronic effects on a marine crustacean, the calanoid copepod Acartia tonsa. Sublethal effects on A. tonsa larvae were investigated with a rapid
Sabine Schnell et al.
Environmental science & technology, 43(24), 9458-9464 (2009-11-26)
Synthetic musks are widely used as perfuming agents in products, such as cosmetics, detergents, and soaps. The increased detection of these substances in the aquatic environment and their high bioconcentration potential raises concerns about potential effects on aquatic species. This
G G Rimkus et al.
Toxicology letters, 111(1-2), 5-15 (2000-01-12)
The monoamino metabolites of the nitro musk fragrances musk xylene (MX) and musk ketone (MK) were analysed simultaneously with their parent compounds by GC/ECD, GC/PND and GC/EI/MS in the various compartments of the aquatic environment. In this review the data
Emiel Rorije et al.
Alternatives to laboratory animals : ATLA, 41(1), 77-90 (2013-04-26)
Read-across as a non-animal testing alternative for the generation of risk assessment data can be useful in those cases where quantitative structure-activity relationship (QSAR) models are not available, or are less well developed. This paper provides read-across case studies for
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