1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid (CAS 4418-45-5) — formula C17H21ClO3, molecular weight 308.8; category organic chemicals.
| CAS Number | 4418-45-5 |
|---|---|
| Molecular Formula | C17H21ClO3 |
| Molecular Weight | 308.8 |
| LogP | 3.8 |
| Category | Organic Chemicals |
1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid is a carbon-based organic compound with CAS registry number 4418-45-5 and molecular formula C17H21ClO3 (molecular weight 308.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4418-45-5
Its molecular formula C17H21ClO3 comprises 17 C, 21 H, 1 Cl, 3 O atoms.
Also known as: 1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid · 1-(邻氯苄基)-α-甲基-2-氧代环己烷丙酸
Category: organic chemicals
The CAS registry number of 1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid is 4418-45-5.
Molecular formula C17H21ClO3, molecular weight 308.8.
It is also registered under: 1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid, 1-(邻氯苄基)-α-甲基-2-氧代环己烷丙酸.
Category: Organic Chemicals.
Independent reference data for 1-(o-Chlorobenzyl)-α-methyl-2-oxocyclohexanepropionic acid (CAS 4418-45-5), compiled from public chemistry databases.
| CAS 号 | 4418-45-5 |
|---|---|
| PubChem CID | 199568 |
| 分子式 | C17H21ClO3 |
| IUPAC 名称 | 3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid |
| Molecular Weight | 308.8 |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 308.1179222 |
| Monoisotopic Mass | 308.1179222 |
| Topological Polar Surface Area | 54.4 |
| Heavy Atom Count | 21 |
BRN 2758742; 1-(o-Chlorobenzyl)-alpha-methyl-2-oxocyclohexanepropionic acid; 4418-45-5; Acido 2-(o-chlorobenzil)cicloessanon-2-beta-isobutirrico [Italian]; Cyclohexanepropionic acid, 1-(o-chlorobenzyl)-alpha-methyl-2-oxo-; Acido 2-(o-chlorobenzil)cicloessanon-2-beta-isobutirrico; RefChem:335410; DTXSID60963182; 3-{1-[(2-Chlorophenyl)methyl]-2-oxocyclohexyl}-2-methylpropanoic acid
1-(邻氯苄基)-α-甲基-2-氧代环己烷丙酸 · CAS 4418-45-5 · C17H21ClO3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-(邻氯苄基)-α-甲基-2-氧代环己烷丙酸