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经验公式(希尔记法):
C20H37Cl3O2
化学文摘社编号:
分子量:
415.87
UNSPSC Code:
41116107
PubChem Substance ID:
MDL number:
InChI
1S/C20H37Cl3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-19(24)20(21,22)23/h2-18H2,1H3
SMILES string
CCCCCCCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl
InChI key
SHVKFBUBFSLWFV-UHFFFAOYSA-N
assay
~95%
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
density
1.03 g/mL at 25 °C (lit.)
application(s)
environmental
format
neat
Gene Information
human ... CA1(759), CA2(760), F2(2147), PRSS1(5644)
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Application
For use as retention index standards in gas chromatography.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Kajal Chakraborty et al.
Natural product research, 33(16), 2329-2337 (2018-03-09)
Two unprecedented benzoxepins were obtained from the ethyl acetate fraction of the leaves of Rhizophora annamalayana Kathir, and characterized as 4-(11-(hydroxymethyl)-10-methylpentan-2-yl)-4, 5-dihydrobenzo[c]oxepin-1(3H)-one (1) and (E)-methyl-14-hydroxy-4-(11-(5-hydroxy-1-oxo-3,4,5-tetrahydrobenzo[c]oxepin-4-yl)ethyl)-10-methylhept-11-enoate (2). The benzoxepin 2 exhibited greater 1, 1-diphenyl-2-picrylhydrazyl and 2, 2'-azino-bis-3 ethylbenzothiozoline-6-sulfonic acid diammonium radical
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