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CAS No.: | 52263-47-5 |
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Name: | 2-(6-Chloro-9H-carbazol-2-yl)propanoic acid |
Molecular Structure: | |
Formula: | C15H12ClNO2 |
Molecular Weight: | 273.7143 |
Synonyms: | 6-Chlor-alpha-methyl-carbazol-2-essigsaeure [German];6-Chloro-alpha-methylcarbazole-2-acetic acid;6-Chloro-alpha-methyl-9H-carbazole-2-acetic acid;Carprofen; |
Density: | 1.42g/cm3 |
Boiling Point: | 509.1 °C at 760 mmHg |
Flash Point: | 261.7 °C |
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Molecular Structure of 2-(6-Chloro-9H-carbazol-2-yl)propanoic acid (CAS NO.52263-47-5):
IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acid
Empirical Formula: C15H12ClNO2
Molecular Weight: 273.7143
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 2
Polar Surface Area: 31.23 Å2
Index of Refraction: 1.731
Molar Refractivity: 77.01 cm3
Molar Volume: 192.6 cm3
Surface Tension: 65.1 dyne/cm
Density: 1.42 g/cm3
Flash Point: 261.7 °C
Enthalpy of Vaporization: 82.09 kJ/mol
Boiling Point: 509.1 °C at 760 mmHg
Vapour Pressure: 3.45E-11 mmHg at 25°C
InChI
InChI=1/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
Smiles
c12c3c(ccc(c3)Cl)[nH]c1cc([C@@H](C(O)=O)C)cc2
Classification Code: Analgesics; Analgesics, Non-Narcotic; Anti-Inflammatory Agents; Anti-inflammatory agents, non-steroidal; Antirheumatic Agents; Dermatologic Agents; Peripheral Nervous System Agents; Photosensitizing agents; Radiation-Sensitizing Agents; Sensory System Agents
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 400mg/kg (400mg/kg) | United States Patent Document. Vol. #3896145, |
2-(6-Chloro-9H-carbazol-2-yl)propanoic acid , with CAS number of 52263-47-5, can be called 6-Chlor-alpha-methyl-carbazol-2-essigsaeure [German] ; 6-Chloro-alpha-methylcarbazole-2-acetic acid ; 2-(6-chloro-9H-carbazol-2-yl)propanoic acid ; 6-Chloro-alpha-methyl-9H-carbazole-2-acetic acid ; Carprofen .