1,3-Di-n-butyl-2-thiobarbituric acid (CAS 54443-89-9) — formula C12H20N2O2S, molecular weight 256.37; category organic chemicals.
| CAS Number | 54443-89-9 |
|---|---|
| Molecular Formula | C12H20N2O2S |
| Molecular Weight | 256.37 |
| LogP | 2.3 |
| Category | Organic Chemicals |
1,3-Di-n-butyl-2-thiobarbituric acid is a carbon-based organic compound with CAS registry number 54443-89-9 and molecular formula C12H20N2O2S (molecular weight 256.37), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 54443-89-9
Its molecular formula C12H20N2O2S comprises 12 C, 20 H, 2 N, 2 O, 1 S atoms.
Also known as: 1,3-Di-n-butyl-2-thiobarbituric acid · 1,3-二正丁基-2-硫代巴比妥酸
Category: organic chemicals
The CAS registry number of 1,3-Di-n-butyl-2-thiobarbituric acid is 54443-89-9.
Molecular formula C12H20N2O2S, molecular weight 256.37.
It is also registered under: 1,3-Di-n-butyl-2-thiobarbituric acid, 1,3-二正丁基-2-硫代巴比妥酸.
Category: Organic Chemicals.
Independent reference data for 1,3-Di-n-butyl-2-thiobarbituric acid (CAS 54443-89-9), compiled from public chemistry databases.
| CAS Registry Number | 54443-89-9 |
|---|---|
| PubChem CID | 108592 |
| Molecular formula | C12H20N2O2S |
| IUPAC name | 1,3-dibutyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
| UNII (FDA) | ST50825973 |
| Molecular Weight | 256.37 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 256.12454906 |
| Monoisotopic Mass | 256.12454906 |
| Topological Polar Surface Area | 72.7 |
| Heavy Atom Count | 17 |
54443-89-9; 1,3-Dibutyl-2-thiobarbituric acid; 4,6(1H,5H)-Pyrimidinedione, 1,3-dibutyldihydro-2-thioxo-; DTXSID4068955; RefChem:72609; 1,3-DBTB; DTXCID5041720; 1,3-Di-n-Butyl-2-Thiobarbituric Acid; 1,3-dibutyl-2-sulfanylidene-1,3-diazinane-4,6-dione; 1,3-Dibutyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione; MFCD00674068; SCHEMBL145408; JNFBSDIDVPDZHB-UHFFFAOYSA-N; AKOS015913135; AS-69761; SY495598
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
1,3-Di-n-butyl-2-thiobarbituric acid · CAS 54443-89-9 · C12H20N2O2S. UNII ST50825973.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1,3-二正丁基-2-硫代巴比妥酸