5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid (CAS 93964-61-5) — formula C25H22ClNO6, molecular weight 467.9; category organic chemicals.
| CAS Number | 93964-61-5 |
|---|---|
| Molecular Formula | C25H22ClNO6 |
| Molecular Weight | 467.9 |
| LogP | 6.1 |
| Applications | Cosmetic and personal-care ingredient |
| Category | Organic Chemicals |
Documented applications: Cosmetic and personal-care ingredient.
5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid is a carbon-based organic compound with CAS registry number 93964-61-5 and molecular formula C25H22ClNO6 (molecular weight 467.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 93964-61-5
Its molecular formula C25H22ClNO6 comprises 25 C, 22 H, 1 Cl, 1 N, 6 O atoms.
Also known as: 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid · 5-[(3-羧基-5-甲基-4-氧代-2,5-环己二烯-1-亚基)[2-氯-4-(二甲氨基)苯基]甲基]-3-甲基水杨酸
Category: organic chemicals
The CAS registry number of 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid is 93964-61-5.
Molecular formula C25H22ClNO6, molecular weight 467.9.
It is also registered under: 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid, 5-[(3-羧基-5-甲基-4-氧代-2,5-环己二烯-1-亚基)[2-氯-4-(二甲氨基)苯基]甲基]-3-甲基水杨酸.
Recorded applications: Cosmetic and personal-care ingredient.
Category: Organic Chemicals.
Independent reference data for 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[2-chloro-4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid (CAS 93964-61-5), compiled from public chemistry databases.
| CAS 号 | 93964-61-5 |
|---|---|
| PubChem CID | 175275 |
| 分子式 | C25H22ClNO6 |
| IUPAC 名称 | 5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-[2-chloro-4-(dimethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid |
| UNII（FDA） | NS00091908 |
| Molecular Weight | 467.9 |
|---|---|
| XLogP3 | 6.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 467.1135651 |
| Monoisotopic Mass | 467.1135651 |
| Topological Polar Surface Area | 115 |
| Heavy Atom Count | 33 |
AAMZDEGBAPMQAP-UHFFFAOYSA-N; DTXSID001102902; NS00091908
5-[(3-羧基-5-甲基-4-氧代-2,5-环己二烯-1-亚基)[2-氯-4-(二甲氨基)苯基]甲基]-3-甲基水杨酸 · CAS 93964-61-5 · C25H22ClNO6. UNII NS00091908.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-[(3-羧基-5-甲基-4-氧代-2,5-环己二烯-1-亚基)[2-氯-4-(二甲氨基)苯基]甲基]-3-甲基水杨酸