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| CAS No.: | 66064-11-7 |
|---|---|
| Name: | N-amino-3-bromophenylsuccinimide |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C10H9BrN2O2 |
| Molecular Weight: | 269.12 |
| Synonyms: | 1-amino-3-(3-bromo-phenyl)-pyrrolidine-2,5-dione;Succinimide,N-amino-2-(m-bromophenyl);IL 16;N-Amino-3-bromophenylsuccinimide;N-Amino-2-(m-bromophenyl)succinimide;1-Amino-3-(3-bromophenyl)-2,5-pyrrolidinedione;Aminoimid kwasu 3-bromofenylobursztynowego [Polish]; |
| Density: | 1.674g/cm3 |
| Boiling Point: | 399.9°C at 760 mmHg |
| Flash Point: | 195.6°C |
| Safety: | Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of Br− and NOx. |
| PSA: | 63.40000 |
| LogP: | 1.80350 |
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Chemistry
Molecule structure of N-Amino-2-(m-bromophenyl)succinimide (CAS NO.66064-11-7):
IUPAC Name: 1-Amino-3-(3-bromophenyl)pyrrolidine-2,5-dione
Molecular Weight: 269.09466 g/mol
Molecular Formula: C10H9BrN2O2
Density: 1.674 g/cm3
Boiling Point: 386.3 °C at 760 mmHg
Flash Point: 187.4 °C
Index of Refraction: 1.64
Molar Refractivity: 57.96 cm3
Molar Volume: 160.7 cm3
Polarizability: 22.97×10-24 cm3
Surface Tension: 61.3 dyne/cm
Enthalpy of Vaporization: 63.52 kJ/mol
Vapour Pressure: 3.58E-06 mmHg at 25 °C
XLogP3-AA: 0.8
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 1
Tautomer Count: 4
Exact Mass: 267.98474
MonoIsotopic Mass: 267.98474
Topological Polar Surface Area: 63.4
Heavy Atom Count: 15
Complexity: 295
Canonical SMILES: C1C(C(=O)N(C1=O)N)C2=CC(=CC=C2)Br
InChI: InChI=1S/C10H9BrN2O2/c11-7-3-1-2-6(4-7)8-5-9(14)13(12)10(8)15/h1-4,8H,5,12H2
InChIKey: QWNKHWJMJANJRD-UHFFFAOYSA-N
Toxicity Data With Reference
| 1. | orl-mus LD50:3682 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 29 (1979),290. | ||
| 2. | ipr-mus LD50:387 mg/kg | EJMCA5 European Journal of Medicinal Chemistry. Chimie Therapeutique. 13 (1978),465. |
Safety Profile
Poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of Br− and NOx.
Specification
N-Amino-2-(m-bromophenyl)succinimide (CAS NO.66064-11-7) is also named as 1-Amino-3-(3-bromophenyl)-2,5-pyrrolidinedione ; 5-21-11-00194 (Beilstein Handbook Reference) ; Aminoimid kwasu 3-bromofenylobursztynowego ; Aminoimid kwasu 3-bromofenylobursztynowego [Polish] ; BRN 1463529 ; IL 16 ; N-Amino-3-bromophenylsuccinimide ; 2,5-Pyrrolidinedione, 1-amino-3-(3-bromophenyl)- (9CI) ; Succinimide, N-amino-2-(m-bromophenyl)- . N-Amino-2-(m-bromophenyl)succinimide (CAS NO.66064-11-7) is moderate toxic. It is flammable. It will produce toxic nitrogen oxide and bromides smoke when buring. So the storage environment should be ventilate, low-temperature and dry.