(1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester (CAS 72554-41-7) — formula C8H10O2S, molecular weight 170.23; category organic chemicals.
| CAS Number | 72554-41-7 |
|---|---|
| Molecular Formula | C8H10O2S |
| Molecular Weight | 170.23 |
| LogP | 1.2 |
| Category | Organic Chemicals |
(1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester is a carbon-based organic compound with CAS registry number 72554-41-7 and molecular formula C8H10O2S (molecular weight 170.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72554-41-7
Its molecular formula C8H10O2S comprises 8 C, 10 H, 2 O, 1 S atoms.
Also known as: (1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester · (1R,5R,6S)-REL-2-硫杂双环[3.1.0]己-3-烯-6-甲酸乙酯
Category: organic chemicals
The CAS registry number of (1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester is 72554-41-7.
Molecular formula C8H10O2S, molecular weight 170.23.
It is also registered under: (1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester, (1R,5R,6S)-REL-2-硫杂双环[3.1.0]己-3-烯-6-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for (1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester (CAS 72554-41-7), compiled from public chemistry databases.
| CAS 号 | 72554-41-7 |
|---|---|
| PubChem CID | 46901652 |
| 分子式 | C8H10O2S |
| IUPAC 名称 | ethyl 2-thiabicyclo[3.1.0]hex-3-ene-6-carboxylate |
| Molecular Weight | 170.23 |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 170.04015073 |
| Monoisotopic Mass | 170.04015073 |
| Topological Polar Surface Area | 51.6 |
| Heavy Atom Count | 11 |
72554-41-7; 2-Thiabicyclo(3.1.0)hex-3-ene-6-carboxylic acid, ethyl ester, (1R,5R,6S)-rel-; 2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid, ethyl ester, (1R,5R,6S)-rel-; RefChem:483714; 619-649-1; Ethyl 2-thiabicyclo[3.1.0]hex-3-ene-6-carboxylate; 90989-08-5; (1R,5R,6S)-rel-2-Thiabicyclo[3.1.0]hex-3-ene-6-carboxylic acid ethyl ester; Ethyl2-thiabicyclo[3.1.0]hex-3-ene-6-carboxylate; SCHEMBL13366845; DTXSID40677154
| 已通报的危害声明 | H311 (100%), H315 (100%) |
|---|
(1R,5R,6S)-REL-2-硫杂双环[3.1.0]己-3-烯-6-甲酸乙酯 · CAS 72554-41-7 · C8H10O2S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.