2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID (CAS 415919-39-0) — formula C13H17NO5S, molecular weight 299.34; category organic chemicals.
| CAS Number | 415919-39-0 |
|---|---|
| Molecular Formula | C13H17NO5S |
| Molecular Weight | 299.34 |
| LogP | -1.7 |
| Category | Organic Chemicals |
2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID is a carbon-based organic compound with CAS registry number 415919-39-0 and molecular formula C13H17NO5S (molecular weight 299.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 415919-39-0
Its molecular formula C13H17NO5S comprises 13 C, 17 H, 1 N, 5 O, 1 S atoms.
Also known as: 2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID · 2-(1,1-二氧代-四氢-1LAMBDA6-噻吩-3-氨基)-3-(4-羟基苯基)-丙酸
Category: organic chemicals
The CAS registry number of 2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID is 415919-39-0.
Molecular formula C13H17NO5S, molecular weight 299.34.
It is also registered under: 2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID, 2-(1,1-二氧代-四氢-1LAMBDA6-噻吩-3-氨基)-3-(4-羟基苯基)-丙酸.
Category: Organic Chemicals.
Independent reference data for 2-(1,1-DIOXO-TETRAHYDRO-1LAMBDA6-THIOPHEN-3-YLAMINO)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID (CAS 415919-39-0), compiled from public chemistry databases.
| CAS 号 | 415919-39-0 |
|---|---|
| PubChem CID | 2772261 |
| 分子式 | C13H17NO5S |
| IUPAC 名称 | 2-[(1,1-dioxothiolan-3-yl)amino]-3-(4-hydroxyphenyl)propanoic acid |
| UNII（FDA） | HMS1614K18 |
| Molecular Weight | 299.34 |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 299.08274382 |
| Monoisotopic Mass | 299.08274382 |
| Topological Polar Surface Area | 112 |
| Heavy Atom Count | 20 |
415919-39-0; 2-[(1,1-dioxothiolan-3-yl)amino]-3-(4-hydroxyphenyl)propanoic acid; (1,1-Dioxidotetrahydrothiophen-3-yl)tyrosine; 2-(1,1-Dioxo-tetrahydrothiophen-3-ylamino)-3-(4-hydroxy-phenyl)-propionic acid; 2-((1,1-Dioxidotetrahydrothiophen-3-yl)amino)-3-(4-hydroxyphenyl)propanoic acid; SBB028064; HMS1614K18; 2-(1,1-dioxotetrahydro-1lambda*6*-thiophen-3-yl-amino)-3-(4-hydroxyphenyl)propionic acid; DTXSID90378200; STK370731; AKOS000269910; AKOS016039783; CCG-113263; 2-(1,1-dioxo-tetrahydro-1lambda6-thiophen-3-ylamino)-3-(4-hydroxy-phenyl)-propionic acid; CS-0268377; ST50001103
2-(1,1-二氧代-四氢-1LAMBDA6-噻吩-3-氨基)-3-(4-羟基苯基)-丙酸 · CAS 415919-39-0 · C13H17NO5S. UNII HMS1614K18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.