3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide (CAS 749-48-4) — formula C23H27NO5S, molecular weight 429.5; category organic chemicals.
3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide is a carbon-based organic compound with CAS registry number 749-48-4 and molecular formula C23H27NO5S (molecular weight 429.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 749-48-4
Its molecular formula C23H27NO5S comprises 23 C, 27 H, 1 N, 5 O, 1 S atoms.
Also known as: 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide
Category: organic chemicals
The CAS registry number of 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide is 749-48-4.
Molecular formula C23H27NO5S, molecular weight 429.5.
It is also registered under: 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide.
Category: Organic Chemicals.
Public-database records for 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide (CAS 749-48-4), reproduced here for independent cross-checking.
| CAS Registry Number | 749-48-4 |
|---|---|
| PubChem CID | 6433213 |
| 分子式 | C23H27NO5S |
| IUPAC 名称 | dimethyl-[(3Z)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]azanium;4-hydroxy-4-oxobutanoate |
Dibenz(b,e)thiepin, 6,11-dihydro-11-(3-(dimethylamino)propylidene)-, 5-oxide, succinate; RefChem:1083287; 6,11-Dihydro-11-(3-(dimethylamino)propylidene)-dibenz(b,e)thiepin 5-oxide succinate; 6,11-Dihydro-11-(3-(dimethylamino)propylidene)-5-oxyd-dibenz(b,e)thiepin succinat [German]; 749-48-4; 6,11-Dihydro-11-(3-(dimethylamino)propylidene)-5-oxyd-dibenz(b,e)thiepin succinat
| 分子量 | 429.5 |
|---|---|
| 氢键供体数 | 2 |
| 氢键受体数 | 6 |
| 可旋转键数 | 5 |
| 精确质量 | 429.16099414 |
| 单同位素质量 | 429.16099414 |
| 拓扑极性表面积 | 118 |
| 重原子数 | 30 |
| 形式电荷 | 0 |
| 复杂度 | 532 |
3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethylpropylamine S-oxide · CAS 749-48-4 · C23H27NO5S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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