492523
Equilin-2,4,16,16-d4
98 atom % D
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About This Item
Empirical Formula (Hill Notation):
C18D4H16O2
CAS Number:
Molecular Weight:
272.37
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352211
MDL number:
Isotopic purity:
98 atom % D
Mass shift:
M+4
Form:
solid
InChI
1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16,19H,2,6-9H2,1H3/t14-,16+,18+/m1/s1/i3D,7D2,10D
SMILES string
[2H]c1cc2[C@H]3CC[C@@]4(C)[C@@H](CC([2H])([2H])C4=O)C3=CCc2c([2H])c1O
InChI key
WKRLQDKEXYKHJB-DLIXUXMWSA-N
isotopic purity
98 atom % D
form
solid
optical activity
[α]25/D 325°, c = 2 in ethanol
technique(s)
mass spectrometry (MS): suitable
mp
238-240 °C (lit.)
mass shift
M+4
Quality Level
Related Categories
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
signalword
Warning
hcodes
Hazard Classifications
Carc. 2 - Repr. 2
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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