5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium (CAS 63148-89-0) — formula C16H20ClNO5S, molecular weight 373.9; category organic chemicals.
| CAS Number | 63148-89-0 |
|---|---|
| Molecular Formula | C16H20ClNO5S |
| Molecular Weight | 373.9 |
| LogP | 3.2 |
| Applications | General Manufacturing Information: Benzoxazolium, 5-chloro-2-(2-ethoxy-1-buten-1-yl)-3-(3-sulfopropyl)-, inner salt: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzoxazolium, 5-chloro-2-(2-ethoxy-1-buten-1-yl)-3-(3-sulfopropyl)-, inner salt: ACTIVE.
5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium is a carbon-based organic compound with CAS registry number 63148-89-0 and molecular formula C16H20ClNO5S (molecular weight 373.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 63148-89-0
Its molecular formula C16H20ClNO5S comprises 16 C, 20 H, 1 Cl, 1 N, 5 O, 1 S atoms.
Also known as: 5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium · 5-氯-2-(2-乙氧基丁-1-烯基)-3-(3-磺基丙基)苯并恶唑鎓
Category: organic chemicals
The CAS registry number of 5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium is 63148-89-0.
Molecular formula C16H20ClNO5S, molecular weight 373.9.
It is also registered under: 5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium, 5-氯-2-(2-乙氧基丁-1-烯基)-3-(3-磺基丙基)苯并恶唑鎓.
Recorded applications: General Manufacturing Information: Benzoxazolium, 5-chloro-2-(2-ethoxy-1-buten-1-yl)-3-(3-sulfopropyl)-, inner salt: ACTIVE.
Category: Organic Chemicals.
Independent reference data for 5-chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium (CAS 63148-89-0), compiled from public chemistry databases.
| CAS 号 | 63148-89-0 |
|---|---|
| PubChem CID | 112598 |
| 分子式 | C16H20ClNO5S |
| IUPAC 名称 | 3-[5-chloro-2-(2-ethoxybut-1-enyl)-1,3-benzoxazol-3-ium-3-yl]propane-1-sulfonate |
| UNII（FDA） | J97JL651P4 |
| Molecular Weight | 373.9 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 373.0750716 |
| Monoisotopic Mass | 373.0750716 |
| Topological Polar Surface Area | 91.8 |
| Heavy Atom Count | 24 |
5-Chloro-2-(2-ethoxybut-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium; J97JL651P4; Benzoxazolium, 5-chloro-2-(2-ethoxy-1-butenyl)-3-(3-sulfopropyl)-, inner salt; EINECS 263-941-8; UNII-J97JL651P4; DTXSID8069723; Benzoxazolium, 5-chloro-2-(2-ethoxy-1-buten-1-yl)-3-(3-sulfopropyl)-, inner salt; Benzoxazolium, 5-chloro-2-(2-ethoxy-1-butenyl)-3-(3-sulfopropyl)-, hydroxide, inner salt; RefChem:102293; DTXCID6043705; 263-941-8; 63148-89-0; SCHEMBL2931708; VWMFWTUKPDOUCL-UHFFFAOYSA-N; 3-(5-Chloro-2-(2-ethoxybut-1-en-1-yl)benzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate; DB-219432
5-氯-2-(2-乙氧基丁-1-烯基)-3-(3-磺基丙基)苯并恶唑鎓 · CAS 63148-89-0 · C16H20ClNO5S. UNII J97JL651P4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.