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Simethicone

CAS 8050-81-5C6H18O4Si3MW 238.46

Simethicone (CAS 8050-81-5) — formula C6H18O4Si3, molecular weight 238.46; category pharmaceutical intermediates and APIs.

Product Overview

CAS Number8050-81-5
Molecular FormulaC6H18O4Si3
Molecular Weight238.46
CategoryPharma Excipients

Technical Profile

What this product is

Simethicone is a pharmaceutical intermediate or API compound with CAS registry number 8050-81-5 and molecular formula C6H18O4Si3 (molecular weight 238.46), belonging to the pharmaceutical intermediates and APIs segment of chemical raw materials.

Identification

CAS number: 8050-81-5

Its molecular formula C6H18O4Si3 comprises 6 C, 18 H, 4 O, 3 Si atoms.

Also known as: Simethicone · 西甲硅油 · POLYDIMETHYLSILOXANE

Category: pharmaceutical intermediates and APIs

Frequently Asked Questions

What is the CAS number of Simethicone?

The CAS registry number of Simethicone is 8050-81-5.

What is the molecular formula and molecular weight of Simethicone?

Molecular formula C6H18O4Si3, molecular weight 238.46.

What other names is Simethicone known by?

It is also registered under: Simethicone, 西甲硅油, POLYDIMETHYLSILOXANE.

Which category does Simethicone belong to?

Category: Pharma Excipients.

PubChem Public Data

Independent reference data for Simethicone (CAS 8050-81-5), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number8050-81-5
PubChem CID6433516
Molecular formulaC6H18O4Si3
IUPAC namedioxosilane;methoxy-dimethyl-trimethylsilyloxysilane
UNII (FDA)SIMETICONE

Computed descriptors

Molecular Weight238.46
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass238.05128865
Monoisotopic Mass238.05128865
Topological Polar Surface Area52.6
Heavy Atom Count13

Documented uses on record

    The main use of simethicone as an excipient is as an antifoaming agent in pharmaceutical manufacturing processes ... .A poly(dimethylsiloxane) which is a polymer of 200-350 units of dimethylsiloxane, along with added silica gel. It is used as an antiflatulent, surfactant, and ointment base.

    Synonyms and trade names

    Simethicone; 8050-81-5; Sentry Simethicone; Mylanta Gas Relief; Mylicon Infant's Drops; Sentry Simethicone Emulsion; DTXSID00904918; RefChem:886342; 3,3,5,5-tetramethyl-2,4-dioxa-3,5-disilahexane; silanedione; 617-098-1; dioxosilane;methoxy-dimethyl-trimethylsilyloxysilane; Simethicon; Simethicone(200); Simethicone(500); SIMETICONE; C6H18O4Si3

    Regulatory listings held on file

    Regulatory & Food ContactANTICAKING_AGENT; ANTIFOAMING_AGENT: Food Additives
    DIMETHYLPOLYSILOXANE
    0–1.5 mg/kg bw
    The Committee withdrew the temporary ADI of 0–0.8 mg/kg body weight per day and re-established the ADI of 0â
    TRS 966-JECFA 74/27
    FAS 60-JECFA 69/165
    GHS notification summary96.6% (86 / 89)

    GHS hazard classification

    GHS notification summary96.6% (86 / 89)
    Reported hazard statementsH225 (100%), H319 (100%), H335 (100%), H336 (100%)

    This chemical does not meet GHS hazard criteria for 96.6% (86 of 89) of all reports.

    Reported as not meeting GHS hazard criteria by 86 of 89 companies (only 3.4% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

    What the public record says

    POLYDIMETHYLSILOXANE · CAS 8050-81-5 · C6H18O4Si3. UNII SIMETICONE.

    Physical description and handling notes

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

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 西甲硅油

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