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| Name |
N-Isopropylterephthalamic acid |
EINECS | N/A |
| CAS No. | 779-47-5 | Density | 1.179g/cm3 |
| PSA | 66.40000 | LogP | 1.91390 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C11H13 N O3 | Boiling Point | 413.9°C at 760 mmHg |
| Molecular Weight | 207.25 | Flash Point | 204.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Terephthalamicacid, N-isopropyl- (7CI,8CI); N-Isopropylterephthalamic acid; Terephthalic acidisopropylamide |
N-Isopropylterephthalamic acid Chemical Properties
Empirical Formula of N-Isopropylterephthalamic acid (CAS NO.779-47-5): C11H13NO3
Molecular Weight: 207.2258
Index of Refraction: 1.55
Density: 1.179 g/cm3
Flash Point: 204.1 °C
Enthalpy of Vaporization: 70.29 kJ/mol
Boiling Point: 413.9 °C at 760 mmHg
Vapour Pressure: 1.37E-07 mmHg at 25 °C
Structure of N-Isopropylterephthalamic acid (CAS NO.779-47-5):
IUPAC Name: 4-(Propan-2-ylcarbamoyl)benzoic acid
Canonical SMILES: CC(C)NC(=O)C1=CC=C(C=C1)C(=O)O
InChI: InChI=1S/C11H13NO3/c1-7(2)12-10(13)8-3-5-9(6-4-8)11(14)15/h3-7H,1-2H3,(H,12,13)(H,14,15)
InChIKey: PRCGIFCKPACTDG-UHFFFAOYSA-N
N-Isopropylterephthalamic acid Safety Profile
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition N-Isopropylterephthalamic acid (CAS NO.779-47-5) emits toxic fumes of NOx.
N-Isopropylterephthalamic acid Specification
N-Isopropylterephthalamic acid , its cas register number is 779-47-5. It also can be called Benzoic acid, 4-(((1-methylethyl)amino)carbonyl)- (9CI) ; Terephthalic acid isopropylamide ; and 4-(((1-Methylethyl)amino)carbonyl)benzoic acid .
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