benzonatate (CAS 104-31-4) — formula C30H53NO11, molecular weight 603.7; category organic chemicals.
benzonatate (CAS 104-31-4) is a chemical raw material in the organic chemicals category. Its molecular formula C30H53NO11 comprises 30 C, 53 H, 1 N, 11 O atoms. Its molecular weight is about 603.7. Reported physicochemical data: LogP about 2.45. 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.
| CAS Number | 104-31-4 |
|---|---|
| Molecular Formula | C30H53NO11 |
| Molecular Weight | 603.7 |
| LogP | 2.45 |
| Applications | MEDICATION, Use (kg) in USA (2002): 10600, Consumption (g per capita) in the USA (2002): 0.0376, Calculated removal (%): 10.5, Methods of Manufacturing: Ethyl p-(butylamino)benzoate is transesterified with a polyethylene glycol monomethyl ether fraction in a methanol solution of sodium methoxide. The crude ester is purified by extracting its benzene solution with sodium carbonate solution, the ester being retained in the benzene |
| Category | Organic Chemicals |
Documented applications: MEDICATION, Use (kg) in USA (2002): 10600, Consumption (g per capita) in the USA (2002): 0.0376, Calculated removal (%): 10.5, Methods of Manufacturing: Ethyl p-(butylamino)benzoate is transesterified with a polyethylene glycol monomethyl ether fraction in a methanol solution of sodium methoxide. The crude ester is purified by extracting its benzene solution with sodium carbonate solution, the ester being retained in the benzene.
benzonatate is a carbon-based organic compound with CAS registry number 104-31-4 and molecular formula C30H53NO11 (molecular weight 603.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 104-31-4
Its molecular formula C30H53NO11 comprises 30 C, 53 H, 1 N, 11 O atoms.
Also known as: benzonatate · 苯佐那酯
Category: organic chemicals
The CAS registry number of benzonatate is 104-31-4.
Molecular formula C30H53NO11, molecular weight 603.7.
It is also registered under: benzonatate, 苯佐那酯.
Recorded applications: MEDICATION, Use (kg) in USA (2002): 10600, Consumption (g per capita) in the USA (2002): 0.0376, Calculated removal (%): 10.5, Methods of Manufacturing: Ethyl p-(butylamino)benzoate is transesterified with a polyethylene glycol monomethyl ether fraction in a methanol solution of sodium methoxide. The crude ester is purified by extracting its benzene solution with sodium carbonate solution, the ester being retained in the benzene.
Category: Organic Chemicals.
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.
Independent reference data for benzonatate (CAS 104-31-4), compiled from public chemistry databases.
| CAS Registry Number | 104-31-4 |
|---|---|
| PubChem CID | 7699 |
| Molecular formula | C30H53NO11 |
| IUPAC name | 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-(butylamino)benzoate |
| UNII (FDA) | 5P4DHS6ENR |
| Molecular Weight | 603.7 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 33 |
| Exact Mass | 603.36186151 |
| Monoisotopic Mass | 603.36186151 |
| Topological Polar Surface Area | 121 |
| Heavy Atom Count | 42 |
| Solubility | 1.59e-03 g/L |
|---|---|
| LogP | 2.45 |
| LogP | log Kow = 2.45 |
| LogP | 1.2 |
Benzonatate; 104-31-4; Benzononatine; Tessalon; Benzonatatum; Benzonatato; Tessalon Perles; Zonatuss; 2,5,8,11,14,17,20,23,26-nonaoxaoctacosan-28-yl 4-(butylamino)benzoate; DTXSID9022655; 2,5,8,11,14,17,20,23,26-Nonaoxaoctacosan-28-yl p-(butylamino)benzoate; nonaethyleneglycol monomethyl ether p-n-butylaminobenzoate; NSC-760128; 4-(butylamino)benzoic acid 3,6,9,12,15,18,21,24,27-nonaoxaoctacos-1-yl ester; Benzoic acid, 4-(butylamino)-, 2,5,8,11,14,17,20,23,26-nonaoxaoctacos-28-yl ester; CHEBI:3032
| Reported hazard statements | H302 (50%), H315 (50%), H319 (50%), H335 (50%), H412 (50%) |
|---|
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
benzonatate · CAS 104-31-4 · C30H53NO11. UNII 5P4DHS6ENR. Solubility: 1.59e-03 g/L; LogP: 2.45; LogP: log Kow = 2.45.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯佐那酯