Bacdanol
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Bacdanol
structure -
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CAS No:
28219-61-6
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Formula:
C14H24O
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Chemical Name:
Bacdanol
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Synonyms:
2-Buten-1-ol,2-ethyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-;2-Ethyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-2-buten-1-ol;Bacdanol;Sanjinol;Bangalol;2-Ethyl-4-(2′,2′,3-trimethylcyclopent-3′-enyl)but-2-enol;Radjanol;Levosandol;Finanol;Sandranol;Radjanol super;Sandalwood 208
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CAS No:
Description
clear colorless to pale yellowish liquid 2-Ethyl-4-(2,2,3-trimethylcyclopent-3-en-yl)-but-2-en-1-ol is amixture of the (E)- and
(Z)-isomers. It is a pale yellow liquid with a powerful sandalwood odor and a slight
rose nuance. The mixture can be prepared starting from α-campholenaldehyde
and butanal. The intermediate unsaturated aldehyde is partially hydrogenated to
give the title alcohol.
It is used in perfume compositions for cosmetics, soaps, and detergents.
Liquid
Characteristics
20.23000
4.97
clear colorless to pale yellowish liquid
0.9±0.1 g/cm3
114-116 °C (1 mmHg)
103.5±15.0 °C
1.478
H2O: INsoluble
-20°C
0.00028mmHg at 25°C
Safety Information
24/25
Stable under normal temperatures and pressures.
|Warning|H315 (16.56%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362, P391, and P501|Aggregated GHS information provided by 1781 companies from 27 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Bacdanol Use and Manufacturing
Odor agents
Air care products
500,000 - 1,000,000 lb
All other chemical product and preparation manufacturing|2-Buten-1-ol, 2-ethyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-: ACTIVE
EPA Safer Chemical Functional Use Classes -> Fragrances|Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern
Computed Properties
Molecular Weight:208.34
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:208.182715385
Monoisotopic Mass:208.182715385
Topological Polar Surface Area:20.2
Heavy Atom Count:15
Complexity:271
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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