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Cas Database |
| Name |
N,N-Bis(2-iodoethyl)aniline |
EINECS | N/A |
| CAS No. | 29523-51-1 | Density | 2.024g/cm3 |
| PSA | 3.24000 | LogP | 3.36300 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H13 I2 N | Boiling Point | 365.7°Cat760mmHg |
| Molecular Weight | 401.029 | Flash Point | 175°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and I−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Aniline,N,N-bis(2-iodoethyl)- (7CI,8CI); N,N-Bis(2-iodoethyl)benzenamine |
Article Data | 6 |
N,N-Bis(2-iodoethyl)aniline Chemical Properties
Product Name: N,N-Bis(2-iodoethyl)aniline (CAS NO.29523-51-1)
Molecular Formula: C10H13I2N
Molecular Weight: 401.04g/mol
Mol File: 29523-51-1.mol
Boiling point: 365.7 °C at 760 mmHg
Flash Point: 175 °C
Density: 2.024 g/cm3
Surface Tension: 53.9 dyne/cm
Enthalpy of Vaporization: 61.21 kJ/mol
Vapour Pressure: 1.54E-05 mmHg at 25°C
XLogP3-AA: 4.3
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of N,N-Bis(2-iodoethyl)aniline (CAS NO.29523-51-1):
IUPAC Name: N,N-bis(2-iodoethyl)aniline
Canonical SMILES: C1=CC=C(C=C1)N(CCI)CCI
InChI: InChI=1S/C10H13I2N/c11-6-8-13(9-7-12)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey: JQLBXLQMDUHDGG-UHFFFAOYSA-N
N,N-Bis(2-iodoethyl)aniline Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 140mg/kg (140mg/kg) | Journal of Medicinal Chemistry. Vol. 8, Pg. 167, 1965. | |
| rat | LD50 | intraperitoneal | 56mg/kg (56mg/kg) | Journal of Medicinal Chemistry. Vol. 8, Pg. 167, 1965. |
N,N-Bis(2-iodoethyl)aniline Safety Profile
A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and I−.
N,N-Bis(2-iodoethyl)aniline Specification
N,N-Bis(2-iodoethyl)aniline ,its CAS NO. is 29523-51-1,the synonyms is 3-12-00-00264 (Beilstein Handbook Reference) ; BRN 2804899 ; Aniline, N,N-bis(2-iodoethyl)- .
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