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122-40-7,MFCD00006988
Catalog No.:AA0016GL

122-40-7 | Alpha-amylcinnamaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25g
98%
in stock  
$24.00   $17.00
- +
500g
90%
in stock  
$36.00   $25.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0016GL
Chemical Name:
Alpha-amylcinnamaldehyde
CAS Number:
122-40-7
Molecular Formula:
C14H18O
Molecular Weight:
202.2921
MDL Number:
MFCD00006988
SMILES:
CCCCCC(=Cc1ccccc1)C=O
FEMA Number:
2061
Properties
Computed Properties
 
Complexity:
199  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
1  
XLogP3:
4.2  

Literature

Title: SENS-IS, a 3D reconstituted epidermis based model for quantifying chemical sensitization potency: Reproducibility and predictivity results from an inter-laboratory study.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20160401

Title: Quantitative determination of some volatile suspected allergens in cosmetic creams spread on skin by direct contact sorptive tape extraction-gas chromatography-mass spectrometry.

Journal: Journal of chromatography. A 20100416

Title: Allergic and photoallergic contact dermatitis from ketoprofen: evaluation of cross-reactivities by a combination of photopatch testing and computerized conformational analysis.

Journal: Current pharmaceutical design 20080101

Title: Sensitization to 26 fragrances to be labelled according to current European regulation. Results of the IVDK and review of the literature.

Journal: Contact dermatitis 20070701

Title: Protein binding and metabolism influence the relative skin sensitization potential of cinnamic compounds.

Journal: Chemical research in toxicology 20040301

Title: Fragrance contact dermatitis: a worldwide multicenter investigation (Part II).

Journal: Contact dermatitis 20010601

Title: Characterization of T cell responses to fragrances.

Journal: Toxicology and applied pharmacology 20010501

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SDS
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Tags:122-40-7 Molecular Formula|122-40-7 MDL|122-40-7 SMILES|122-40-7 Alpha-amylcinnamaldehyde
Catalog No.: AA0016GL
122-40-7,MFCD00006988
122-40-7 | Alpha-amylcinnamaldehyde
Pack Size： 25g
Purity： 98%
in stock
$24.00 $17.00
Pack Size： 500g
Purity： 90%
in stock
$36.00 $25.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0016GL
Chemical Name: Alpha-amylcinnamaldehyde
CAS Number: 122-40-7
Molecular Formula: C14H18O
Molecular Weight: 202.2921
MDL Number: MFCD00006988
SMILES: CCCCCC(=Cc1ccccc1)C=O
FEMA Number: 2061
Properties
Complexity: 199  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 1  
XLogP3: 4.2  
Literature fold

Title: SENS-IS, a 3D reconstituted epidermis based model for quantifying chemical sensitization potency: Reproducibility and predictivity results from an inter-laboratory study.

Journal: Toxicology in vitro : an international journal published in association with BIBRA20160401

Title: Quantitative determination of some volatile suspected allergens in cosmetic creams spread on skin by direct contact sorptive tape extraction-gas chromatography-mass spectrometry.

Journal: Journal of chromatography. A20100416

Title: Allergic and photoallergic contact dermatitis from ketoprofen: evaluation of cross-reactivities by a combination of photopatch testing and computerized conformational analysis.

Journal: Current pharmaceutical design20080101

Title: Sensitization to 26 fragrances to be labelled according to current European regulation. Results of the IVDK and review of the literature.

Journal: Contact dermatitis20070701

Title: Protein binding and metabolism influence the relative skin sensitization potential of cinnamic compounds.

Journal: Chemical research in toxicology20040301

Title: Fragrance contact dermatitis: a worldwide multicenter investigation (Part II).

Journal: Contact dermatitis20010601

Title: Characterization of T cell responses to fragrances.

Journal: Toxicology and applied pharmacology20010501

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