alpha-Hexylcinnamaldehyde
Also known as (2E)-2-benzylideneoctanal, 2-Benzylideneoctanal, alpha-Hexylcinnamic aldehyde
Key facts
What buyers check first
- CAS number
- 101-86-0
- Formula
- C15H20O
- Molar mass
- 216.32 g/mol
- Physical form
- Solid
- HS code
- 291229
- Category
- Synthetic aroma chemicals

What is alpha-Hexylcinnamaldehyde?
Plain description, key identifiers and synonyms
Alpha-hexylcinnamaldehyde is a member of the class of cinnamaldehydes carrying a hexyl substituent at the alpha-position. It is functionally related to an (E)-cinnamaldehyde.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (2E)-2-benzylideneoctanal
- CAS number
- 101-86-0Other or deprecated CAS: 165184-98-5
- EC numbers
- 202-983-3, 639-566-4
- Molecular formula
- C15H20O
- UNII
- E9947QRR9O
- MDL number
- MFCD00006989
- INCI name
- HEXYL CINNAMAL
- InChIKey
- GUUHFMWKWLOQMM-NTCAYCPXSA-N
- InChI
- InChI=1S/C15H20O/c1-2-3-4-6-11-15(13-16)12-14-9-7-5-8-10-14/h5,7-10,12-13H,2-4,6,11H2,1H3/b15-12+
- Canonical SMILES
- CCCCCCC(C=O)=Cc1ccccc1
- Isomeric SMILES
- CCCCCC/C(=C\C1=CC=CC=C1)/C=O
Synonyms
- (2E)-2-benzylideneoctanal
- 2-Benzylideneoctanal
- alpha-Hexylcinnamic aldehyde
- alpha-Hexylcinnamyl aldehyde
- alpha-Hexyl-beta-phenylacrolein
- alpha-n-Hexyl-beta-phenylacrolein
- Octanal, 2-(phenylmethylene)-
- CINNAMALDEHYDE, alpha-HEXYL-
- hexyl cinnamaldehyde
- Hexylcinnamaldehyde
- Hexylcinnamal
- (E)-2-benzylideneoctanal
- (2E)-2-(phenylmethylidene)octanal
- 2-(Phenylmethylene)octanal
- 2-Hexenyl cynnamaldehyde
- 2-Hexyl-3-phenyl-2-propenal
- Hexyl cinnamic aldehyde (VAN)
- a-hexylcinnamaldehyde
- n-Hexyl cinnamaldehyde
- 2-Hexyl-3-phenyl-propenal
- 2-(phenylmethylene)-octanal
- alpha -hexylcinnamaldehyde
- alpha-n-hexylcinnamaldehyde
- 2-[(E)-benzylidene]octanal
- Hexylzimtaldehyd
Show all 33 synonymsShow fewer synonyms
- alpha-Hexylcinnamaldehyde, (2E)-
- ?-Hexylcinnamaldehyde
- alpha-hexylcinna-maldehyde
- Hexyl-3-phenyl-propenal
- a-Hexylcinnamaldehyde, 8CI
- alpha -hexylcinnamic aldehyde
- Cinnamaldehyde, alpha -hexyl-
- (2E)-alpha-n-hexylcinnamaldehyde
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Physical form | Solidexp.Measured value |
|---|
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 216.32 g/molcalc.Computed value |
|---|---|
| Exact mass | 216.1514 Dacalc.Computed value |
| LogP (octanol/water) | 4.24calc.Computed value |
| Topological polar surface area | 17.07 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 7calc.Computed value |
| Heavy atoms | 16calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.4calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H317May cause an allergic skin reaction.
- H400Very toxic to aquatic life.
- H411Toxic to aquatic life with long lasting effects.
Precautionary statements (10)
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P272Contaminated work clothing should not be allowed out of the workplace.
- P273Avoid release to the environment.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P302 + P352If on skin: Wash with plenty of water.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P333 + P317If skin irritation or rash occurs: Get medical help.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P391Collect spillage.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidalpha-Hexylcinnamaldehyde suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India ManufacturerUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- China, WuhanUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- China, FuzhouUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- ManufacturerUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- United States, New AlbanyUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- United Kingdom, Leek ManufacturerUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- Mexico, Tlalnepantla de BazUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- China, ChangzhouUnclaimed profilealpha-HexylcinnamaldehydeGrade, purity and minimum order on requestPrice on request
- Price on request
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Where suppliers are based
24 suppliers in 9 countries
- United States9
- China4
- India2
- Spain1
- France1
- United Kingdom1
- and 3 more countries
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alpha-Hexylcinnamaldehyde price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industrial uses: Fragrance, Flavoring and nutrient.
Consumer uses: Fragrance.
Industries and functions
Cosmetic ingredient, INCI name HEXYL CINNAMAL(perfuming)
Functional uses
- Deodorizer
- Flavouring and nutrient
- Fragrance
Cosmetic functions
- Perfuming
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- EU cosmetic ingredient inventory
- EU Cosmetics Regulation Annex III, restricted in cosmeticsName: HEXYL CINNAMAL, Ref no: 87, Annex ref: III/87
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code alpha-Hexylcinnamaldehyde is traded under.
Cyclic aldehydes without other oxygen function, other
- United States22.5%
- China9.2%
- Singapore8.4%
* Partner reported figures, a lower bound.
The HS code shown for alpha-Hexylcinnamaldehyde is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about alpha-Hexylcinnamaldehyde, based on the data on this page
What is alpha-Hexylcinnamaldehyde?
What is the CAS number of alpha-Hexylcinnamaldehyde?
What is the molecular formula and weight of alpha-Hexylcinnamaldehyde?
What is alpha-Hexylcinnamaldehyde used for?
Is alpha-Hexylcinnamaldehyde hazardous?
What is the HS code of alpha-Hexylcinnamaldehyde?
Where can I buy alpha-Hexylcinnamaldehyde?
Where can I buy alpha-Hexylcinnamaldehyde in India?
What is the price of alpha-Hexylcinnamaldehyde?
Guides for buyers
Practical guides that help when you source, ship or handle alpha-Hexylcinnamaldehyde
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, FormulationHow to choose a cosmetic emulsifierA structured way to choose an emulsifier for creams and lotions: emulsion type, HLB and its limits, emulsifier families, formula fit, stability testing and what to ask suppliers.Read
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