δ-Cadinene
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δ-Cadinene
structure -
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CAS No:
483-76-1
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Formula:
C15H24
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Chemical Name:
δ-Cadinene
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Synonyms:
Naphthalene,1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-,(1S,8aR)-;δ-Cadinene;Cadina-1(10),4-diene;Naphthalene,1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-,(1S-cis)-;(1S,8aR)-1,2,3,5,6,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)naphthalene;(+)-δ-Cadinene;δ-Cadinene,(+)-;(1S-cis)-1,2,3,5,6,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)naphthalene;19912-65-3
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CAS No:
Description
(+)-delta-cadinene is a member of the cadinene family of sesquiterpenes in which the double bonds are located at the 4-4a and 7-8 positions, and in which the isopropyl group at position 1 is cis to the hydrogen at the adjacent bridgehead carbon (the 1S,8aR-enantiomer). It is a delta-cadinene and a cadinene. It is an enantiomer of a (-)-delta-cadinene.
Characteristics
0
6.54
0.9146 g/cm3 @ Temp: 420 °C
279.7±15.0 °C at 760 mmHg
110.5±15.2 °C
1.499
0.04863 mg/L @ 25 °C (est)
Safety Information
UN 2319 3/PG 3
3
10-36/37/38
26-36
EU8900000
Xi
|Danger|H304 (100%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]|P264, P280, P301+P310, P302+P352, P321, P331, P332+P313, P362, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
δ-Cadinene Use and Manufacturing
Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C15 isoprenoids (sesquiterpenes) [PR0103]
Computed Properties
Molecular Weight:204.35
XLogP3:3.8
Rotatable Bond Count:1
Exact Mass:204.187800766
Monoisotopic Mass:204.187800766
Heavy Atom Count:15
Complexity:304
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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