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2-Methyl-4-phenylbutyraldehyde

CAS 40654-82-8C11H14OMW 162.10 g/mol

2-Methyl-4-phenylbutyraldehyde (CAS 40654-82-8) — formula C11H14O, molecular weight 162.10 g/mol.

Product Overview

CAS Number40654-82-8
Molecular FormulaC11H14O
Molecular Weight162.10 g/mol
Boiling Point253.00 °C. @ 760.00 mm Hg
LogP2.5
Packaging25/50kg 编织袋、20/25/50kg 纸板桶、200kg 塑料桶、1000kg IBC(以订单确认为准)
Applications典型应用领域:食品增香, 日化。规格, 纯度:以批次 COA 为准。包装:25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。

Applications

Documented applications: 典型应用领域:食品增香, 日化。规格, 纯度:以批次 COA 为准。包装:25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.

Packaging & Storage

Packaging25/50kg 编织袋、20/25/50kg 纸板桶、200kg 塑料桶、1000kg IBC(以订单确认为准)

Technical Profile

What this product is

2-Methyl-4-phenylbutyraldehyde is a chemical compound with CAS registry number 40654-82-8 and molecular formula C11H14O (molecular weight 162.10 g/mol).

Identification

CAS number: 40654-82-8

Its molecular formula C11H14O comprises 11 C, 14 H, 1 O atoms.

Also known as: 2-Methyl-4-phenylbutyraldehyde · Α-甲基苯丁醛

Frequently Asked Questions

What is the CAS number of 2-Methyl-4-phenylbutyraldehyde?

The CAS registry number of 2-Methyl-4-phenylbutyraldehyde is 40654-82-8.

What is the molecular formula and molecular weight of 2-Methyl-4-phenylbutyraldehyde?

Molecular formula C11H14O, molecular weight 162.10 g/mol.

What other names is 2-Methyl-4-phenylbutyraldehyde known by?

It is also registered under: 2-Methyl-4-phenylbutyraldehyde, Α-甲基苯丁醛.

What are the documented applications of 2-Methyl-4-phenylbutyraldehyde?

Recorded applications: 典型应用领域:食品增香, 日化。规格, 纯度:以批次 COA 为准。包装:25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC(以订单确认为准)。储存:阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.

PubChem Public Data

Independent reference data for 2-Methyl-4-phenylbutyraldehyde (CAS 40654-82-8), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number40654-82-8
PubChem CID62911
Molecular formulaC11H14O
Molecular weight162.10 g/mol
IUPAC name2-methyl-4-phenylbutanal
InChIKeyRLFLIPVJQTWXKR-UHFFFAOYSA-N
UNII (FDA)1E564V2EQV
FEMA number2737
JECFA number1462

Computed descriptors

Molecular Weight162.23
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass162.104465066
Monoisotopic Mass162.104465066
Topological Polar Surface Area17.1
Heavy Atom Count12

Physicochemical values on record

Boiling Point253.00 °C. @ 760.00 mm Hg
Boiling Point253 °C
Density0.968-0975
Refractive Index1.506-1.510

Documented uses on record

    Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional ClassesFlavoring Agents -> JECFA Flavorings Index

    Synonyms and trade names

    2-Methyl-4-phenylbutanal; 2-Methyl-4-phenylbutyraldehyde; alpha-Methylbenzenebutanal; Benzenebutanal, alpha-methyl-; 4-Phenyl-2-methylbutanal; FEMA No. 2737; Butyraldehyde, 2-methyl-4-phenyl-; Benzenebutanal, .alpha.-methyl-; EINECS 255-022-5; UNII-1E564V2EQV; 1E564V2EQV; DTXSID80866005; .ALPHA.-METHYLBENZENEBUTANAL; 2-METHYL-4-PHENYLBUTYRALDEHYDE [FHFI]; RefChem:88151; DTXCID60814347

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Floral
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary12.2% (11 / 90)

    GHS hazard classification

    GHS notification summary12.2% (11 / 90)
    Reported hazard statementsH317 (85.6%)

    This chemical does not meet GHS hazard criteria for 12.2% (11 of 90) of reports.

    H317 (85.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]

    What the public record says

    2-Methyl-4-phenylbutyraldehyde is identified by CAS 40654-82-8, molecular formula C11H14O and molecular weight 162.10 g/mol. UNII 1E564V2EQV; InChIKey RLFLIPVJQTWXKR-UHFFFAOYSA-N. Boiling Point: 253.00 °C. @ 760.00 mm Hg; Boiling Point: 253 °C; Density: 0.968-0975.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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