S-Phenylmercapturic Acid (CAS 4775-80-8) — formula C11H13NO3S, molecular weight 239.29; category organic chemicals.
| CAS Number | 4775-80-8 |
|---|---|
| Molecular Formula | C11H13NO3S |
| Molecular Weight | 239.29 |
| LogP | 1.4 |
| Category | Organic Chemicals |
S-Phenylmercapturic Acid is a carbon-based organic compound with CAS registry number 4775-80-8 and molecular formula C11H13NO3S (molecular weight 239.29), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4775-80-8
Its molecular formula C11H13NO3S comprises 11 C, 13 H, 1 N, 3 O, 1 S atoms.
Also known as: S-Phenylmercapturic Acid · S-苯硫醇酸
Category: organic chemicals
The CAS registry number of S-Phenylmercapturic Acid is 4775-80-8.
Molecular formula C11H13NO3S, molecular weight 239.29.
It is also registered under: S-Phenylmercapturic Acid, S-苯硫醇酸.
Category: Organic Chemicals.
Independent reference data for S-Phenylmercapturic Acid (CAS 4775-80-8), compiled from public chemistry databases.
| CAS Registry Number | 4775-80-8 |
|---|---|
| PubChem CID | 95526 |
| Molecular formula | C11H13NO3S |
| IUPAC name | 2-acetamido-3-phenylsulfanylpropanoic acid |
| UNII (FDA) | ST50949970 |
| Molecular Weight | 239.29 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 239.06161445 |
| Monoisotopic Mass | 239.06161445 |
| Topological Polar Surface Area | 91.7 |
| Heavy Atom Count | 16 |
2-acetamido-3-phenylsulfanylpropanoic acid; 20614-68-0; RefChem:1062084; DTXCID001437438; DTXSID801344809; 20640-68-0; DL-Phenylmercapturic Acid; 2-(Acetylamino)-3-(phenylthio)propanoic acid; 2-Acetamido-3-(phenylthio)propanoic acid; Cysteine, N-acetyl-S-phenyl-; MFCD00059335; (+/-)-Phenylmercapturic acid; 2-acetamido-3-(phenylsulfanyl)propanoic acid; S-PMA; 2-(acetylamino)-3-phenylthiopropanoic acid; Ac-DL-Cys(Ph)-OH
S-Phenylmercapturic Acid · CAS 4775-80-8 · C11H13NO3S. UNII ST50949970.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: S-苯硫醇酸