1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid (CAS 90839-68-2) — formula C9H6ClN3O2, molecular weight 223.61; category organic chemicals.
| CAS Number | 90839-68-2 |
|---|---|
| Molecular Formula | C9H6ClN3O2 |
| Molecular Weight | 223.61 |
| LogP | 2.2 |
| Category | Organic Chemicals |
1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid is a carbon-based organic compound with CAS registry number 90839-68-2 and molecular formula C9H6ClN3O2 (molecular weight 223.61), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 90839-68-2
Its molecular formula C9H6ClN3O2 comprises 9 C, 6 H, 1 Cl, 3 N, 2 O atoms.
Also known as: 1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid · 1-(3-氯苯基)-1H-1,2,4-噻唑-3-羧酸
Category: organic chemicals
The CAS registry number of 1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid is 90839-68-2.
Molecular formula C9H6ClN3O2, molecular weight 223.61.
It is also registered under: 1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid, 1-(3-氯苯基)-1H-1,2,4-噻唑-3-羧酸.
Category: Organic Chemicals.
Independent reference data for 1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid (CAS 90839-68-2), compiled from public chemistry databases.
| CAS 号 | 90839-68-2 |
|---|---|
| PubChem CID | 71301927 |
| 分子式 | C9H6ClN3O2 |
| IUPAC 名称 | 1-(3-chlorophenyl)-1,2,4-triazole-3-carboxylic acid |
| Molecular Weight | 223.61 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 223.0148541 |
| Monoisotopic Mass | 223.0148541 |
| Topological Polar Surface Area | 68 |
| Heavy Atom Count | 15 |
90839-68-2; 1-(3-chlorophenyl)-1H-1,2,4-triazole-3-carboxylic acid; DTXSID50744467; RefChem:224302; DTXCID80695211; 1-(3-CHLOROPHENYL)-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID; 1-(3-Chloro-phenyl)-1H-[1,2,4]triazole-3-carboxylic acid; SCHEMBL15019823; 1-(3-Chlorophenyl)-1H-1,2,4-triazole-3-carboxylicacid; YVKFFPKGAPZNQR-UHFFFAOYSA-N; 1-(3-Chloro-phenyl)-1H-[1,2,4]-triazole-3-carboxylic acid; AKOS016013993; AT36572; DB-237651; 1H-1,2,4-triazole-3-carboxylicacid-1-(3-chlorophenyl)
1-(3-氯苯基)-1H-1,2,4-噻唑-3-羧酸 · CAS 90839-68-2 · C9H6ClN3O2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.