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Cas Database |
| Name |
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid |
EINECS | N/A |
| CAS No. | 30544-72-0 | Density | 1.255g/cm3 |
| PSA | 57.61000 | LogP | 4.46840 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C19H20 Cl N O3 | Boiling Point | 539.4°Cat760mmHg |
| Molecular Weight | 345.826 | Flash Point | 280°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl− and NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Butyricacid, 4-(p-chloro-N-2,6-xylylbenzamido)- (8CI); N-(p-Chlorobenzoyl)-g-(2,6-dimethylanilino)butyricacid |
Article Data | 3 |
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid Chemical Properties
The Molecular Structure of -(p-Chloro-N-2,6-xylylbenzamido)butyric acid (CAS NO.30544-72-0):
Molecular Formula: C19H20ClNO3
Molecular Weight: 345.820000 g/mol
IUPAC: 4-(N-(4-chlorobenzoyl)-2,6-dimethylanilino)butanoic acid
Index of Refraction: 1.61
Molar Refractivity: 95.54 cm3
Molar Volume: 275.4 cm3
Surface Tension: 52.7 dyne/cm
Density: 1.255 g/cm3
Flash Point: 280 °C
Enthalpy of Vaporization: 85.96 kJ/mol
Boiling Point: 539.4 °C at 760 mmHg
Vapour Pressure: 1.83E-12 mmHg at 25°C
InChI
InChI=1/C19H20ClNO3/c1-13-5-3-6-14(2)18(13)21(12-4-7-17(22)23)19(24)15-8-10-16(20)11-9-15/h3,5-6,8-11H,4,7,12H2,1-2H3,(H,22,23)
Smiles
N(c1c(cccc1C)C)(C(c1ccc(Cl)cc1)=O)CCCC(O)=O
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid Toxicity Data With Reference
| 1. | orl-rat LD50:1900 mg/kg | GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent Office, Science Library, 2021 Jefferson Davis Highway, Arlington, VA 22202) #1917036 . | ||
| 2. | ivn-rat LD50:300 mg/kg | GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent Office, Science Library, 2021 Jefferson Davis Highway, Arlington, VA 22202) #1917036 . | ||
| 3. | orl-mus LD50:710 mg/kg | GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent Office, Science Library, 2021 Jefferson Davis Highway, Arlington, VA 22202) #1917036 . | ||
| 4. | ipr-mus LD50:305 mg/kg | GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent Office, Science Library, 2021 Jefferson Davis Highway, Arlington, VA 22202) #1917036 . |
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid Safety Profile
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl− and NOx.
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid Specification
4-(p-Chloro-N-2,6-xylylbenzamido)butyric acid (CAS NO.30544-72-0) is also called as B 66347 ; B 67347 ; BRN 2773081 ; N-(p-Chlorbenzoyl)-gamma-(2,6-dimethylanilino)-buttersaeure ; N-(p-Chlorbenzoyl)-gamma-(2,6-dimethylanilino)-buttersaeure [German] ; Butyric acid, 4-(p-chloro-N-2,6-xylylbenzamido)- .
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