Simethicone (CAS 8050-81-5) — formula C6H18O4Si3, molecular weight 238.46; category pharmaceutical intermediates and APIs.
| CAS Number | 8050-81-5 |
|---|---|
| Molecular Formula | C6H18O4Si3 |
| Molecular Weight | 238.46 |
| Category | Pharma Excipients |
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.
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
The CAS registry number of Simethicone is 8050-81-5.
Molecular formula C6H18O4Si3, molecular weight 238.46.
It is also registered under: Simethicone, 西甲硅油, POLYDIMETHYLSILOXANE.
Category: Pharma Excipients.
Independent reference data for Simethicone (CAS 8050-81-5), compiled from public chemistry databases.
| CAS Registry Number | 8050-81-5 |
|---|---|
| PubChem CID | 6433516 |
| Molecular formula | C6H18O4Si3 |
| IUPAC name | dioxosilane;methoxy-dimethyl-trimethylsilyloxysilane |
| UNII (FDA) | SIMETICONE |
| Molecular Weight | 238.46 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 238.05128865 |
| Monoisotopic Mass | 238.05128865 |
| Topological Polar Surface Area | 52.6 |
| Heavy Atom Count | 13 |
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 & Food Contact | ANTICAKING_AGENT; ANTIFOAMING_AGENT: Food Additives DIMETHYLPOLYSILOXANE 0â1.5 mg/kg bw The Committee withdrew the temporary ADI of 0â0.8 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 summary | 96.6% (86 / 89) |
| GHS notification summary | 96.6% (86 / 89) |
|---|---|
| Reported hazard statements | H225 (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.
POLYDIMETHYLSILOXANE · CAS 8050-81-5 · C6H18O4Si3. UNII SIMETICONE.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 西甲硅油