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Phenylacetaldehyde

CAS 122-78-1C8H8OMW 120.06 g/mol

Phenylacetaldehyde (CAS No. 122-78-1) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Fine Chemicals;Pharmaceutical Intermediates;Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Specifications

CAS Number122-78-1
Molecular FormulaC8H8O
Molecular Weight120.06 g/mol
Melting Point33.5
Boiling Point195
LogP1.78
Purity按批次COA提供(不公开发布)
Packaging按订单/批次确认(不公开发布)
ApplicationsFine Chemicals;Pharmaceutical Intermediates;Flavors
CategoryFine Chemicals|Pharmaceutical Intermediates|Flavors

Where it is used

Fine Chemicals;Pharmaceutical Intermediates;Flavors

Packaging & Supply

Packaging按订单/批次确认(不公开发布)
Purity按批次COA提供(不公开发布)
StorageSealed, cool and dry place
Lead TimeIn stock / per order

Documents & Support

COA provided with every batch; MSDS and technical documents available on request. Email us with product name and CAS number for a quote within one business day.

Frequently Asked Questions

What is the CAS number of Phenylacetaldehyde?

The CAS number of Phenylacetaldehyde is 122-78-1.

What purity and packaging are available?

Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.

What are the applications of Phenylacetaldehyde?

Main applications include Fine Chemicals;Pharmaceutical Intermediates;Flavors.

How do I buy Phenylacetaldehyde or get a quote?

Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..

PubChem Public Data

Description

Phenylacetaldehyde is identified by CAS 122-78-1, molecular formula C8H8O and molecular weight 120.06 g/mol. UNII U8J5PLW9MR; ChEBI 16424; InChIKey DTUQWGWMVIHBKE-UHFFFAOYSA-N. Boiling Point: 195; Boiling Point: 195 °C; Melting Point: 33.5.

Identification

CAS Registry Number122-78-1
PubChem CID998
Molecular formulaC8H8O
Molecular weight120.06 g/mol
IUPAC name2-phenylacetaldehyde
InChIKeyDTUQWGWMVIHBKE-UHFFFAOYSA-N
UNII (FDA)U8J5PLW9MR
ChEBI IDCHEBI:16424
FEMA number2874
JECFA number1002

Computed Descriptors

Molecular Weight120.15
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass120.057514874
Monoisotopic Mass120.057514874
Topological Polar Surface Area17.1
Heavy Atom Count9
Formal Charge0

Physical & Chemical Properties

Boiling Point195
Boiling Point195 °C
Melting Point33.5
Melting Point120.5 - 121.5 °C
Density1.023-1.045
Vapor Pressure0.39 [mmHg]
LogP1.78
Refractive Index1.524-1.545

Physical description & handling notes

  • Colorless oily liquid that polymerizes and becomes thicker on standing; Odor like lilac and hyacinth; mp = 33-34 deg C; [Merck Index] Colorless to yellow liquid; [Acros Organics MSDS]
  • Solid
  • Colourless to slighty yellow oily liquid; very powerful and penetrating pungent green floral and sweet odour of hyacinth type
  • Slightly soluble in water; insoluble in water; soluble in oils, propylene glycol
  • 1 mL in 2 mL 80% ethanol (in ethanol)
  • 122.7 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID3021483]

Regulatory Status

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Berry, Geranium, Honey, Nut, Pungent
No safety concern at current levels of intake when used as a flavouring agent

GHS Hazard Classification

Reported hazard statementsH302 (99.8%), H314 (80%), H317 (96.8%), H318 (78.6%)

H302 (99.8%): Harmful if swallowed [Warning Acute toxicity, oral]

H314 (80%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Documented Uses

  • This is an endogenously produced metabolite found in the human body. It is used in metabolic reactions, catabolic reactions or waste generation.
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index
  • Information on 5 consumer products that contain Phenylacetaldehyde in the following categories is provided:
  • Benzeneacetaldehyde; Benzylcarboxaldehyde; Hyacinthin; 1-Oxo-2-phenylethane; α-Tolualdehyde; α-Toluic aldehyde; Phenylacetic aldehyde; Phenyl acetic aldehyde (pure) (commercial name)
  • IFRA 51st Amendment - Guidance for the use of IFRA Standards

Synonyms

phenylacetaldehyde; 2-phenylacetaldehyde; 122-78-1; Benzeneacetaldehyde; 2-Phenylethanal; alpha-Tolualdehyde; Phenylethanal; Phenylacetic aldehyde; alpha-Toluic aldehyde; Oxophenylethane; Acetaldehyde, phenyl-; Benzylcarboxaldehyde; 1-Oxo-2-phenylethane; Phenacetaldehyde; alpha-Phenylacetaldehyde; FEMA No. 2974

Frequently Asked Questions

What are the CAS number and molecular formula of Phenylacetaldehyde?

CAS 122-78-1; molecular formula C8H8O; molecular weight 120.06 g/mol.

What other names is Phenylacetaldehyde known by?

phenylacetaldehyde, 2-phenylacetaldehyde, 122-78-1, Benzeneacetaldehyde, 2-Phenylethanal, alpha-Tolualdehyde.

What is the regulatory status of Phenylacetaldehyde?

Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT; Flavoring Agents.

Is Phenylacetaldehyde classified as hazardous?

Hazard statements reported: H302, H314, H317, H318.

What are the key physical properties of Phenylacetaldehyde?

Boiling Point: 195; Boiling Point: 195 °C; Melting Point: 33.5; Melting Point: 120.5 - 121.5 °C.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.

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