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Methyl benzyl disulfide

CAS 699-10-5C8H10S2MW 170.02 g/mol

Methyl benzyl disulfide (CAS 699-10-5) — formula C8H10S2, molecular weight 170.02 g/mol; category food flavors.

Product Description

Methyl benzyl disulfide (CAS 699-10-5) is a chemical raw material in the food flavors category. Its molecular formula C8H10S2 comprises 8 C, 10 H, 2 S atoms. Its molecular weight is about 170.02 g/mol. Reported physicochemical data: melting point around 61.00 to 62.00 °C. @ 760.00 mm Hg, boiling point around 195.00 to 197.00 °C. @ 760.00 mm Hg, LogP about 2.4. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number699-10-5
Molecular FormulaC8H10S2
Molecular Weight170.02 g/mol
Melting Point61.00 to 62.00 °C. @ 760.00 mm Hg
Boiling Point195.00 to 197.00 °C. @ 760.00 mm Hg
LogP2.4
ApplicationsFlavouring Agent, Flavoring Agents, Disulfide, methyl phenylmethyl: INACTIVE
CategoryFlavors

Applications

Documented applications: Flavouring Agent, Flavoring Agents, Disulfide, methyl phenylmethyl: INACTIVE.

Technical Profile

What this product is

Methyl benzyl disulfide is a flavoring compound with CAS registry number 699-10-5 and molecular formula C8H10S2 (molecular weight 170.02 g/mol), belonging to the food flavors segment of chemical raw materials.

Identification

CAS number: 699-10-5

Its molecular formula C8H10S2 comprises 8 C, 10 H, 2 S atoms.

Also known as: Methyl benzyl disulfide · benzyl methyl disulphide · Benzyl Methyl Disulfide

Category: food flavors

Frequently Asked Questions

What is the CAS number of Methyl benzyl disulfide?

The CAS registry number of Methyl benzyl disulfide is 699-10-5.

What is the molecular formula and molecular weight of Methyl benzyl disulfide?

Molecular formula C8H10S2, molecular weight 170.02 g/mol.

What other names is Methyl benzyl disulfide known by?

It is also registered under: Methyl benzyl disulfide, benzyl methyl disulphide, Benzyl Methyl Disulfide.

What are the documented applications of Methyl benzyl disulfide?

Recorded applications: Flavouring Agent, Flavoring Agents, Disulfide, methyl phenylmethyl: INACTIVE.

Which category does Methyl benzyl disulfide belong to?

Category: Flavors.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for Methyl benzyl disulfide (CAS 699-10-5), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number699-10-5
PubChem CID12779
Molecular formulaC8H10S2
Molecular weight170.02 g/mol
IUPAC name(methyldisulfanyl)methylbenzene
InChIKeyNWYGPVZOBBHKLI-UHFFFAOYSA-N
UNII (FDA)Q451CNJ59W
ChEBI IDCHEBI:173775
FEMA number3504
JECFA number577

Computed descriptors

Molecular Weight170.3
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass170.02239267
Monoisotopic Mass170.02239267
Topological Polar Surface Area50.6
Heavy Atom Count10

Physicochemical values on record

Boiling Point195.00 to 197.00 °C. @ 760.00 mm Hg
Boiling Point82-86 °C (0.8 mm Hg)
Melting Point61.00 to 62.00 °C. @ 760.00 mm Hg
Density0.840 (d20/4)

Documented uses on record

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

    Synonyms and trade names

    Benzyl methyl disulfide; Methyl benzyl disulfide; Disulfide, methyl phenylmethyl; Benzyldithiomethane; [(Methyldisulfanyl)methyl]benzene; Benzyl methyl disulphide; DISULFIDE, BENZYL METHYL; Methyl phenylmethyl disulfide; FEMA No. 3504; EINECS 211-826-8; UNII-Q451CNJ59W; NSC 677547; BRN 2079563; Q451CNJ59W; NSC-677547; METHYL BENZYL DISULPHIDE

    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
    Savory
    No safety concern at current levels of intake when used as a flavouring agent

    GHS hazard classification

    Reported hazard statementsH302 (100%), H315 (72.8%), H319 (72.8%), H335 (72.8%)

    H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

    H315 (72.8%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    Methyl benzyl disulfide is identified by CAS 699-10-5, molecular formula C8H10S2 and molecular weight 170.02 g/mol. UNII Q451CNJ59W; ChEBI 173775; InChIKey NWYGPVZOBBHKLI-UHFFFAOYSA-N. Boiling Point: 195.00 to 197.00 °C. @ 760.00 mm Hg; Boiling Point: 82-86 °C (0.8 mm Hg); Melting Point: 61.00 to 62.00 °C. @ 760.00 mm Hg.

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

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