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Tiglic aldehyde, also known as 2-Methyl-2-butenal, is a volatile organic compound characterized by its colorless to light yellow clear liquid appearance and a strong, pleasant, fruity odor. It is synthesized from perillaldehyde and is recognized for its sharp, citrusy scent, making it a popular choice in the cosmetic, food, and perfume industries as a fragrance and flavoring agent. However, it is important to note that it can be a skin, eye, and respiratory tract irritant, with potential for causing allergic skin reactions upon prolonged exposure. Its chemical formula is C5H8O.

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  • 1115-11-3 Structure
  • Basic information

    1. Product Name: Tiglic aldehyde
    2. Synonyms: methyl-2-butenal,2-methyl-2-butenal;2,3-DIMETHYLACROLEIN;2-Methylcrotonaldehyde;Tiglic aldehyde;trans-2,3-Dimethylacrolein;trans-2-Methyl-2-butenal;2,3-Dimethyl-2-propenal;2,3-Dimethylacrylaldehyde
    3. CAS NO:1115-11-3
    4. Molecular Formula: C5H8O
    5. Molecular Weight: 84.12
    6. EINECS: 207-833-0
    7. Product Categories: N/A
    8. Mol File: 1115-11-3.mol
  • Chemical Properties

    1. Melting Point: -101.15°C (estimate)
    2. Boiling Point: 116-119 °C
    3. Flash Point: 21 °C
    4. Appearance: /
    5. Density: 0.871
    6. Vapor Pressure: 17.1mmHg at 25°C
    7. Refractive Index: 1.448
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: Tiglic aldehyde(CAS DataBase Reference)
    11. NIST Chemistry Reference: Tiglic aldehyde(1115-11-3)
    12. EPA Substance Registry System: Tiglic aldehyde(1115-11-3)
  • Safety Data

    1. Hazard Codes: F,Xi
    2. Statements: 10-36/37/38
    3. Safety Statements: 16-26-36
    4. RIDADR: UN 1989
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: N/A
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 1115-11-3(Hazardous Substances Data)

1115-11-3 Usage

Uses

Used in the Cosmetic Industry:
Tiglic aldehyde is used as a fragrance ingredient in the cosmetic industry for its ability to impart a sharp, citrusy scent to various products, enhancing their appeal to consumers.
Used in the Food Industry:
In the food industry, Tiglic aldehyde serves as a flavoring agent, adding a distinctive citrus flavor to food products, thereby improving their taste and consumer experience.
Used in the Perfume Industry:
Tiglic aldehyde is utilized as a key component in perfumery, where its strong, pleasant, fruity odor contributes to the creation of various fragrances, providing a unique and attractive scent profile.
It is crucial to handle Tiglic aldehyde with care due to its potential irritant properties, ensuring that it is used in appropriate concentrations and within safe exposure limits to minimize the risk of adverse effects on skin, eyes, and the respiratory tract.

Check Digit Verification of cas no

The CAS Registry Mumber 1115-11-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,1,1 and 5 respectively; the second part has 2 digits, 1 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 1115-11:
(6*1)+(5*1)+(4*1)+(3*5)+(2*1)+(1*1)=33
33 % 10 = 3
So 1115-11-3 is a valid CAS Registry Number.
InChI:InChI=1/C5H8O/c1-3-5(2)4-6/h3-4H,1-2H3/b5-3+

1115-11-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name Tiglic aldehyde

1.2 Other means of identification

Product number -
Other names trans-2-Methyl-3-heptene

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1115-11-3 SDS

1115-11-3Relevant articles and documents

Chromium-Catalyzed Production of Diols From Olefins

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Paragraph 0111, (2021/03/19)

Processes for converting an olefin reactant into a diol compound are disclosed, and these processes include the steps of contacting the olefin reactant and a supported chromium catalyst comprising chromium in a hexavalent oxidation state to reduce at least a portion of the supported chromium catalyst to form a reduced chromium catalyst, and hydrolyzing the reduced chromium catalyst to form a reaction product comprising the diol compound. While being contacted, the olefin reactant and the supported chromium catalyst can be irradiated with a light beam at a wavelength in the UV-visible spectrum. Optionally, these processes can further comprise a step of calcining at least a portion of the reduced chromium catalyst to regenerate the supported chromium catalyst.

The bioinspired design of a reagent allows the functionalization of Cα-H of α,β-unsaturated carbonyl compounds via the Baylis-Hillman chemistry under ambient conditions

Singh, Palwinder,Kumar, Arun,Kaur, Sukhmeet,Kaur, Jagroop,Singh, Harpreet

supporting information, p. 2936 - 2939 (2016/02/20)

A rationally designed reagent capable of affecting alkylation at Cα of α,β-unsaturated carbonyl compounds is reported. The reaction proceeded at room temperature without any additives. The pH and H-bond formation during the reaction play a key role in the working of the reagent.

The effect of pH on the formation of aroma compounds produced by heating a model system containing l-ascorbic acid with l-threonine/l-serine

Yu, Ai-Nong,Zhang, Ai-Dong

experimental part, p. 214 - 219 (2011/12/14)

The identification of aroma compounds, formed from the reactions of l-ascorbic acid with l-threonine/l-serine at five different pH values (5.00, 6.00, 7.00, 8.00, or 9.55) and 143 ± 2 °C for 2 h, was performed using a SPME-GC-MS technique, and further use

BIOMIMETIC SYNTHESIS OF BACTERIAL C50 CAROTENOIDS DECAPRENOXANTHIN AND C.p. 450

Ferezou, Jean-Pierre,Julia, Marc

, p. 1277 - 1288 (2007/10/02)

Alkylation of the distal double bond of pseudoionone 4 has been carried out with isoprene epoxide (ZnCl2/MeNO2) leading directly to α-cis 10a, α-trans 10b and γ 10c hydroxyprenylionones.The α-cis and γ-isomers have been converted in few steps into the C50 carotenoids decaprenoxanthin 1 and C.p. 450 3 respectively.

INTERACTIONS OF SINGLET OXYGEN WITH 2,5-DIMETHYL-2,4-HEXADIENE IN POLAR AND NON-POLAR SOLVENTS EVIDENCE FOR A VINYLOG ENE-REACTION

Gollnick, Klaus,Griesbeck, Axel

, p. 3235 - 3250 (2007/10/02)

2,5-Dimethyl-2,4-hexadiene (1) was studied as a singlet oxygen acceptor in various solvents. 1 undergoes concomitantly the three well-known modes of singlet oxygen reactions: (1) the ene-reaction to give the allylic hydroperoxide 3, (2) the (4+2)-cycloaddition to give the endoperoxide 4, and (3) the (2+2)-cycloaddition to give the dioxetane 2.Beyond that (and in contrast to simple olefins), there are (4) "physical" quenching and (5) a "vinylog ene-reaction" to give the twofold-unsaturated hydroperoxide 5.The latter reaction represents a novel mode of singlet oxygen interaction with a substituted 1,3-diene. - Kinetic analysis shows that "physical" quenching, endoperoxide and vinylog ene-product formations proceed with solvent-independent rates; the rates of dioxetane and ene-product formations, however, are solvent-dependent. - A mechanism (Scheme 3) is proposed, according to which endoperoxide formation is due to a concerted singlet oxygen reaction with the s-cis-conformational isomer 1b; with the s-trans-isomer 1a, "physical" quenching and the vinylog ene-reaction proceed via a non-polar singlet diradical intermediate, whereas the ene-product formation occurs via a perepoxide-like transition state.In aprotic solvents, the dioxetane is mainly formed via a "tight-geometry intermediate", in methanolic solution via a solvent-stabilized zwitterion; the latter is also responsible for the formation of the methanol-addition product 6.

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