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| CAS No.: | 932-83-2 |
|---|---|
| Name: | N-NITROSOHEXAMETHYLENEIMINE |
| Article Data: | 15 |
| Molecular Structure: | |
|
|
|
| Formula: | C6H12 N2 O |
| Molecular Weight: | 128.174 |
| Synonyms: | N-Nitrosoazacycloheptane;N-Nitrosohexahydroazepine; N-Nitrosohexamethylenimine; Nitrosohexamethylenimine |
| Density: | 1.13g/cm3 |
| Boiling Point: | 247°Cat760mmHg |
| Flash Point: | 103.2°C |
| Solubility: | 12.82g/L(24 oC) |
| Hazard Symbols: |
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| Risk Codes: | 45-22-36/37/38 |
| Safety: | Suspected carcinogen with experimental carcinogenic, tumorigenic, and teratogenic data. Poison by ingestion, intraperitoneal, and subcutaneous routes. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS. |
| PSA: | 32.67000 |
| LogP: | 1.48170 |
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Chemistry
IUPAC Name: 1-nitrosoazepane
Synonyms of N-Nitrosohexahydroazepine (CAS NO.932-83-2): 5-20-04-00067 (Beilstein Handbook Reference) ; BRN 1237798 ; CCRIS 468 ; EINECS 213-258-6 ; Hexahydro-1-nitroso-1H-azepine ; N-6-MI ; N-Nitrosoazacycloheptane ; N-Nitrosohexamethyleneimine ; N-Nitrosoperhydroazepine ; Nitrosohexamethyleneimine ; Nitrosohexamethylenimine ; 1H-Azepine, hexahydro-1-nitroso-
CAS NO: 932-83-2
Molecular Formula of N-Nitrosohexahydroazepine (CAS NO.932-83-2): C6H12N2O
Molecular Weight: 128.1723
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 32.67 Å2
Index of Refraction: 1.54
Molar Refractivity: 35.5 cm3
Molar Volume: 113.1 cm3
Surface Tension: 43.6 dyne/cm
Density of N-Nitrosohexahydroazepine (CAS NO.932-83-2): 1.13 g/cm3
Flash Point: 103.2 °C
Enthalpy of Vaporization: 46.45 kJ/mol
Boiling Point: 247 °C at 760 mmHg
Vapour Pressure: 0.0414 mmHg at 25°C
Molecular Structure:
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Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| hamster | LD50 | subcutaneous | 142mg/kg (142mg/kg) | LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LIVER: OTHER CHANGES KIDNEY, URETER, AND BLADDER: "INFLAMMATION, NECROSIS, OR SCARRING OF BLADDER" | Journal of the National Cancer Institute. Vol. 50, Pg. 323, 1973. |
| mouse | LD50 | subcutaneous | 65mg/kg (65mg/kg) | LUNGS, THORAX, OR RESPIRATION: CHRONIC PULMONARY EDEMA LIVER: OTHER CHANGES KIDNEY, URETER, AND BLADDER: CHANGES IN BLOOD VESSELS OR IN CIRCULATION OF KIDNEY | Zeitschrift fuer Krebsforschung und Klinische Onkologie. Vol. 78, Pg. 78, 1972. |
| rat | LD50 | intraperitoneal | 300mg/kg (300mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Cancer Research. Vol. 28, Pg. 1217, 1968. |
| rat | LD50 | oral | 336mg/kg (336mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Cancer Research. Vol. 28, Pg. 1217, 1968. |
Safety Profile
Hazard Codes: 
T
Risk Statements: 45-22-36/37/38
R45: May cause cancer.
R22: Harmful if swallowed.
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 53-36/37/39-45
S53: Avoid exposure - obtain special instructions before use.
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
WGK Germany: 3
RTECS: CM3325000
Suspected carcinogen with experimental carcinogenic, tumorigenic, and teratogenic data. Poison by ingestion, intraperitoneal, and subcutaneous routes. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also N-NITROSO COMPOUNDS.