BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID (CAS 87242-91-9) — formula C16H22O2S, molecular weight 278.4; category organic chemicals.
| CAS Number | 87242-91-9 |
|---|---|
| Molecular Formula | C16H22O2S |
| Molecular Weight | 278.4 |
| LogP | 3.9 |
| Category | Organic Chemicals |
BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID is a carbon-based organic compound with CAS registry number 87242-91-9 and molecular formula C16H22O2S (molecular weight 278.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 87242-91-9
Its molecular formula C16H22O2S comprises 16 C, 22 H, 2 O, 1 S atoms.
Also known as: BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID · β-(4-甲基-苄基磺酰基)-β,β-环五亚甲基-丙酸
Category: organic chemicals
The CAS registry number of BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID is 87242-91-9.
Molecular formula C16H22O2S, molecular weight 278.4.
It is also registered under: BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID, β-(4-甲基-苄基磺酰基)-β,β-环五亚甲基-丙酸.
Category: Organic Chemicals.
Independent reference data for BETA-(4-METHYL-BENZYLSULFANYL)-BETA,BETA-CYCLOPENTAMETHYLENE-PROPIONIC ACID (CAS 87242-91-9), compiled from public chemistry databases.
| CAS 号 | 87242-91-9 |
|---|---|
| PubChem CID | 7021416 |
| 分子式 | C16H22O2S |
| IUPAC 名称 | 2-[1-[(4-methylphenyl)methylsulfanyl]cyclohexyl]acetic acid |
| Molecular Weight | 278.4 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 278.13405111 |
| Monoisotopic Mass | 278.13405111 |
| Topological Polar Surface Area | 62.6 |
| Heavy Atom Count | 19 |
87242-91-9; [1-(4-Methyl-benzylsulfanyl)-cyclohexyl]-acetic acid; Beta-(4-methylbenzylsulfanyl)-beta,beta-cyclopentamethylene-propionic acid; 2-[1-[(4-methylphenyl)methylsulfanyl]cyclohexyl]acetic Acid; MFCD00080282; b-(4-Methylbenzyl)mercapto-b,b-cyclopenta-methylene-propionic acid; C16H22O2S; F493156; 2-[1-(p-tolylmethylsulfanyl)cyclohexyl]acetic acid; Cyclohexaneacetic acid, 1-[[(4-methylphenyl)methyl]thio]-; 2-(1-{[(4-methylphenyl)methyl]sulfanyl}cyclohexyl)acetic acid; Beta-(4-methylbenzylsulfanyl)-beta,beta-cyclopentamethylene-propionicacid
β-(4-甲基-苄基磺酰基)-β,β-环五亚甲基-丙酸 · CAS 87242-91-9 · C16H22O2S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.