3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID (CAS 13739-36-1) — formula C10H12O3S, molecular weight 212.27; category organic chemicals.
| CAS Number | 13739-36-1 |
|---|---|
| Molecular Formula | C10H12O3S |
| Molecular Weight | 212.27 |
| LogP | 1.9 |
| Category | Organic Chemicals |
3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID is a carbon-based organic compound with CAS registry number 13739-36-1 and molecular formula C10H12O3S (molecular weight 212.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13739-36-1
Its molecular formula C10H12O3S comprises 10 C, 12 H, 3 O, 1 S atoms.
Also known as: 3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID · 3-[(4-甲氧基苯基)硫代]丙酸
Category: organic chemicals
The CAS registry number of 3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID is 13739-36-1.
Molecular formula C10H12O3S, molecular weight 212.27.
It is also registered under: 3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID, 3-[(4-甲氧基苯基)硫代]丙酸.
Category: Organic Chemicals.
Independent reference data for 3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID (CAS 13739-36-1), compiled from public chemistry databases.
| CAS Registry Number | 13739-36-1 |
|---|---|
| PubChem CID | 4431444 |
| Molecular formula | C10H12O3S |
| IUPAC name | 3-(4-methoxyphenyl)sulfanylpropanoic acid |
| UNII (FDA) | Z103338270 |
| Molecular Weight | 212.27 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 212.05071541 |
| Monoisotopic Mass | 212.05071541 |
| Topological Polar Surface Area | 71.8 |
| Heavy Atom Count | 14 |
3-[(4-methoxyphenyl)thio]propanoic acid; 3-((4-methoxyphenyl)thio)propanoic acid; 3-[(4-methoxyphenyl)sulfanyl]propanoic acid; 3-((4-Methoxyphenyl)sulfanyl)propanoic acid; RefChem:488667; 831-720-0; 13739-36-1; 3-(4-methoxyphenyl)sulfanylpropanoic Acid; Propanoic acid, 3-[(4-methoxyphenyl)thio]-; MFCD00219548; F2182-0133; Propanoic acid,3-[(4-methoxyphenyl)thio]-; Oprea1_543835; SCHEMBL12587; DTXSID20403231; YGLGCLKWXCJXRC-UHFFFAOYSA-N
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
3-[(4-METHOXYPHENYL)THIO]PROPANOIC ACID · CAS 13739-36-1 · C10H12O3S. UNII Z103338270.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-[(4-甲氧基苯基)硫代]丙酸