Dimethyl 3-Thiaadipate (CAS 7400-45-5) — formula C7H12O4S, molecular weight 192.24; category organic chemicals.
| CAS Number | 7400-45-5 |
|---|---|
| Molecular Formula | C7H12O4S |
| Molecular Weight | 192.24 |
| LogP | 0.6 |
| Category | Organic Chemicals |
Dimethyl 3-Thiaadipate is a carbon-based organic compound with CAS registry number 7400-45-5 and molecular formula C7H12O4S (molecular weight 192.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7400-45-5
Its molecular formula C7H12O4S comprises 7 C, 12 H, 4 O, 1 S atoms.
Also known as: Dimethyl 3-Thiaadipate · 3-硫代己二酸二甲酯
Category: organic chemicals
The CAS registry number of Dimethyl 3-Thiaadipate is 7400-45-5.
Molecular formula C7H12O4S, molecular weight 192.24.
It is also registered under: Dimethyl 3-Thiaadipate, 3-硫代己二酸二甲酯.
Category: Organic Chemicals.
Independent reference data for Dimethyl 3-Thiaadipate (CAS 7400-45-5), compiled from public chemistry databases.
| CAS Registry Number | 7400-45-5 |
|---|---|
| PubChem CID | 81891 |
| Molecular formula | C7H12O4S |
| IUPAC name | methyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate |
| Molecular Weight | 192.24 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 192.04563003 |
| Monoisotopic Mass | 192.04563003 |
| Topological Polar Surface Area | 77.9 |
| Heavy Atom Count | 12 |
7400-45-5; Dimethyl 3-thiaadipate; Propanoic acid, 3-[(2-methoxy-2-oxoethyl)thio]-, methyl ester; EINECS 231-002-1; NSC 59279; DTXSID6064662; Propanoic acid, 3-((2-methoxy-2-oxoethyl)thio)-, methyl ester; RefChem:176353; DTXCID1047607; XNDKLLFGXIEGKL-UHFFFAOYSA-N; Methyl 3-((2-methoxy-2-oxoethyl)thio)propanoate; Methyl 3-[(2-methoxy-2-oxoethyl)sulfanyl]propanoate; Methyl 3-[(2-methoxy-2-oxoethyl)thio]propionate; MFCD00043633; methyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate; Methyl 3-(methoxycarbonylmethylthio)propionate
| Reported hazard statements | H226 (100%) |
|---|
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Dimethyl 3-Thiaadipate · CAS 7400-45-5 · C7H12O4S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-硫代己二酸二甲酯