1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane (CAS 6790-58-5) — formula C16H28O, molecular weight 236.21 g/mol.
| CAS Number | 6790-58-5 |
|---|---|
| Molecular Formula | C16H28O |
| Molecular Weight | 236.21 g/mol |
| LogP | 4.7 |
| Applications | Use Classification: Fragrance Ingredients, Industry Uses: Fragrance, Consumer Uses: Fragrance, Household Products: Information on 29 consumer products that contain Ambroxide in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, U.S. Production: 2023: 100, 000 - <250, 000 lb, 2022: 250, 000 - <400, 2021: 100, 2020: 100, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, Naphtho[2, 1-b]furan, dodecahydro-3a, 6, 9a-tetramethyl-, (3aR, 5aS, 9aS, 9bR)-: ACTIVE |
Documented applications: Use Classification: Fragrance Ingredients, Industry Uses: Fragrance, Consumer Uses: Fragrance, Household Products: Information on 29 consumer products that contain Ambroxide in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, U.S. Production: 2023: 100, 000 - <250, 000 lb, 2022: 250, 000 - <400, 2021: 100, 2020: 100, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, Naphtho[2, 1-b]furan, dodecahydro-3a, 6, 9a-tetramethyl-, (3aR, 5aS, 9aS, 9bR)-: ACTIVE.
1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane is a chemical compound with CAS registry number 6790-58-5 and molecular formula C16H28O (molecular weight 236.21 g/mol).
CAS number: 6790-58-5
Its molecular formula C16H28O comprises 16 C, 28 H, 1 O atoms.
Also known as: 1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane · Ambroxan
The CAS registry number of 1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane is 6790-58-5.
Molecular formula C16H28O, molecular weight 236.21 g/mol.
It is also registered under: 1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane, Ambroxan.
Recorded applications: Use Classification: Fragrance Ingredients, Industry Uses: Fragrance, Consumer Uses: Fragrance, Household Products: Information on 29 consumer products that contain Ambroxide in the following categories is provided:, • Auto Products, • Commercial, Institutional, • Inside the Home, U.S. Production: 2023: 100, 000 - <250, 000 lb, 2022: 250, 000 - <400, 2021: 100, 2020: 100, General Manufacturing Information: Soap, Cleaning Compound, and Toilet Preparation Manufacturing, All Other Chemical Product and Preparation Manufacturing, Naphtho[2, 1-b]furan, dodecahydro-3a, 6, 9a-tetramethyl-, (3aR, 5aS, 9aS, 9bR)-: ACTIVE.
Independent reference data for 1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane (CAS 6790-58-5), compiled from public chemistry databases.
| CAS Registry Number | 6790-58-5 |
|---|---|
| PubChem CID | 10857465 |
| Molecular formula | C16H28O |
| Molecular weight | 236.21 g/mol |
| IUPAC name | (3aR,5aS,9aS,9bR)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran |
| InChIKey | YPZUZOLGGMJZJO-LQKXBSAESA-N |
| UNII (FDA) | TD34B3O8M9 |
| ChEBI ID | CHEBI:78307 |
| Molecular Weight | 236.39 |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 236.214015512 |
| Monoisotopic Mass | 236.214015512 |
| Topological Polar Surface Area | 9.2 |
| Heavy Atom Count | 17 |
(-)-Ambroxide; 6790-58-5; Ambroxide; Ambroxan; (-)-ambrox; DTXSID0047113; K60YJF1E9A; Ambroxide, (-)-; (3aR,5aS,9aS,9bR)-3a,6,6,9a-tetramethyldodecahydronaphtho[2,1-b]furan; TD34B3O8M9; AMBERMOX; AMBROFIX; ORCANOX; CHEBI:78307; AMBROXIDE [MI]; (3aR,5aS,9aS,9bR)-3a,6,6,9a-tetramethyl-2,4,5,5a,7,8,9,9b-octahydro-1H-benzo[e][1]benzofuran
| Regulatory & Food Contact | FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT 1,5,5,9-TETRAMETHYL-13-OXATRICYCLO(8.3.0.0(4,9))TRIDECANE |
|---|---|
| GHS notification summary | 99.9% (1600 / 1601) |
| GHS notification summary | 99.9% (1600 / 1601) |
|---|
This chemical does not meet GHS hazard criteria for > 99.9% (1600 of 1601) of all reports.
Reported as not meeting GHS hazard criteria by 1600 of 1601 companies (only < 0.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
1,5,5,9-Tetramethyl-13-oxatricyclo[8.3.0.0(4,9)]tridecane is identified by CAS 6790-58-5, molecular formula C16H28O and molecular weight 236.21 g/mol. UNII TD34B3O8M9; ChEBI 78307; InChIKey YPZUZOLGGMJZJO-LQKXBSAESA-N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
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