α-Hexylcinnamaldehyde
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α-Hexylcinnamaldehyde
structure -
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CAS No:
101-86-0
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Formula:
C15H20O
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Chemical Name:
α-Hexylcinnamaldehyde
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Synonyms:
Octanal,2-(phenylmethylene)-;Cinnamaldehyde,α-hexyl-;2-(Phenylmethylene)octanal;α-Hexylcinnamaldehyde;Hexyl cinnamic aldehyde;α-n-Hexyl-β-phenylacrolein;α-Hexylcinnamic aldehyde;2-Hexyl-3-phenyl-2-propenal;2-Hexylcinnamaldehyde;α-Hexylcinnamyl aldehyde;α-n-Hexylcinnamaldehyde;NSC 406799;NSC 46150;2-Benzylideneoctanal;Hexyl cinnamal
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CAS No:
Description
Hexyl cinnamaldehyde has a jasmine-like odor, particularly on dilution. alpha-Hexylcinnamaldehyde is a yellow liquid with a mild, slightly fatty, floral, somewhat herbal odor, and a distinct jasmine note. Similarly to the "-amyl homolog, "-hexylcinnamaldehydemust be protected against oxidation by the addition of stabilizers. It is prepared in a manner similar to that of "-amylcinnamaldehyde by alkaline condensation of excess benzaldehyde with octanal (instead of heptanal). "-Hexylcinnama
Liquid|Pale yellow liquid, jasmine like odour
Characteristics
17.1
4.23930
Liquid
0.95 g/mL at 25 °C(lit.)
39.2 °C
305 °C
200 °F
n 20/D 1.55(lit.)
water: soluble0.005g/L at 25°C
2-8°C
0.000697mmHg at 25°C
The acute oral LD 50 value in rats was reported as 3.1 g/kg (2.45-3.75 g/kg) (Moreno, 1971). The acute dermal LD 50 value in rabbits was reported as > 3 g/kg (Moreno, 1971).
Safety Information
UN 3265 8/PG 3
2
36/37/38-34-43-52/53
26-36/37/39-45-36-36/37-61
GD6560000
C,Xi
P280
H317
|Warning|H317 (99.71%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501|Aggregated GHS information provided by 2411 companies from 32 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H315: Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P272, P280, P302+P352, P321, P332+P313, P333+P313, P362, P363, and P501
α-Hexylcinnamaldehyde Use and Manufacturing
From the condensation of octanal and benzaldehyde.
α-Hexylcinnamaldehyde is characterized by a typical floral scent, which makes them suitable to be used as fragrances in personal care (perfumes, creams, shampoos, etc.) and household products. It has been also used as flavouring additive in food and pharmaceutical industry.
Flavor and Fragrance
Air care products
10,000,000 - 50,000,000 lb
All other basic organic chemical manufacturing|Octanal, 2-(phenylmethylene)-: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:216.32
XLogP3:4.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:216.151415257
Monoisotopic Mass:216.151415257
Topological Polar Surface Area:17.1
Heavy Atom Count:16
Complexity:212
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of α-Hexylcinnamaldehyde
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![China]()
CN
YRS
Business licensedTrader Supplier of Apigenin,PQQ,NMNHInquiryUnit Price: $100 /KG EXWCAS No.: 101-86-0Grade: Pharmaceutical gradContent: 99% -
![China]()
CN
YRS
Business licensedTrader Supplier of Organic Intermediate,Organic Intermediate,Organic Intermediate,Organic Intermediate,Organic IntermediateInquiryUnit Price: nullnull /null nullCAS No.: 101-86-0Grade: Industrial Grade
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