4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID (CAS 80866-86-0) — formula C18H16O5, molecular weight 312.3; category organic chemicals.
| CAS Number | 80866-86-0 |
|---|---|
| Molecular Formula | C18H16O5 |
| Molecular Weight | 312.3 |
| LogP | 2.6 |
| Category | Organic Chemicals |
4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID is a carbon-based organic compound with CAS registry number 80866-86-0 and molecular formula C18H16O5 (molecular weight 312.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80866-86-0
Its molecular formula C18H16O5 comprises 18 C, 16 H, 5 O atoms.
Also known as: 4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID · 4-[4-(2-羧基苯甲酰)苯基]丁酸
Category: organic chemicals
The CAS registry number of 4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID is 80866-86-0.
Molecular formula C18H16O5, molecular weight 312.3.
It is also registered under: 4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID, 4-[4-(2-羧基苯甲酰)苯基]丁酸.
Category: Organic Chemicals.
Independent reference data for 4-[4-(2-CARBOXYBENZOYL)PHENYL]BUTYRIC ACID (CAS 80866-86-0), compiled from public chemistry databases.
| CAS 号 | 80866-86-0 |
|---|---|
| PubChem CID | 3008366 |
| 分子式 | C18H16O5 |
| IUPAC 名称 | 2-[4-(3-carboxypropyl)benzoyl]benzoic acid |
| UNII（FDA） | NS00061528 |
| Molecular Weight | 312.3 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 312.09977361 |
| Monoisotopic Mass | 312.09977361 |
| Topological Polar Surface Area | 91.7 |
| Heavy Atom Count | 23 |
80866-86-0; 4-[4-(2-Carboxybenzoyl)phenyl]butyric acid; 2-[4-(3-carboxypropyl)benzoyl]benzoic acid; 2-[[4-(3-carboxypropyl)phenyl]-oxomethyl]benzoic acid; 2-(4-(3-Carboxypropyl)benzoyl)benzoic acid; 4-(2-Carboxybenzoyl)benzenebutyric acid; EINECS 279-590-9; CBiol_000216; CBiol_000239; CHEMBL82883; SCHEMBL503666; PBCSZTCIOAKNOF-UHFFFAOYSA-N; DTXSID301001597; ICCB2_000216; ICCB2_000239; DB-056471
4-[4-(2-羧基苯甲酰)苯基]丁酸 · CAS 80866-86-0 · C18H16O5. UNII NS00061528.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-[4-(2-羧基苯甲酰)苯基]丁酸