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CAS No.: | 25726-99-2 |
---|---|
Name: | 3-(DIBUTYLAMINO)PROPIONITRILE |
Article Data: | 21 |
Molecular Structure: | |
Formula: | C11H22 N2 |
Molecular Weight: | 182.309 |
Synonyms: | Propionitrile,3-(dibutylamino)- (6CI,7CI,8CI); 3-(Dibutylamino)propionitrile;3-Dibutylaminopropanenitrile; N,N-Dibutyl-3-aminopropionitrile; NSC 62640 |
Density: | 0.8513 |
Boiling Point: | 120 °C (10 mmHg) |
Flash Point: | 110.8°C |
Hazard Symbols: | Xi |
Risk Codes: | R36/37/38 |
Safety: | A poison by ingestion and skin contact. When heated to decomposition it emits toxic vapors of NOx. |
PSA: | 27.03000 |
LogP: | 2.80228 |
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Product Name: 3-(Dibutylamino)propionitrile (CAS NO.25726-99-2)
Molecular Formula: C11H22N2
Molecular Weight: 182.31g/mol
Mol File: 25726-99-2.mol
Einecs: 247-211-6
Appearance: Clear brown liquid
Boiling point: 287.3 °C at 760 mmHg
Flash Point: 110.8 °C
Density: 0.865 g/cm3
Refractive index: 1.44-1.444
Surface Tension: 32.6 dyne/cm
Enthalpy of Vaporization: 52.64 kJ/mol
Vapour Pressure: 0.00251 mmHg at 25°C
XLogP3-AA: 2.5
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of 3-(Dibutylamino)propionitrile (CAS NO.25726-99-2):
IUPAC Name: 3-(dibutylamino)propanenitrile
Canonical SMILES: CCCCN(CCCC)CCC#N
InChI: InChI=1S/C11H22N2/c1-3-5-9-13(10-6-4-2)11-7-8-12/h3-7,9-11H2,1-2H3
InChIKey: XNHGXTPCDNEDCH-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rabbit | LD50 | skin | 5040uL/kg (5.04mL/kg) | American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969. | |
rat | LD50 | oral | 3250uL/kg (3.25mL/kg) | American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969. |
A poison by ingestion and skin contact. When heated to decomposition it emits toxic vapors of NOx.
Safety Information of 3-(Dibutylamino)propionitrile (CAS NO.25726-99-2):
Hazard Codes: Xi
Risk Statements: 36/37/38
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements: 37/39-26
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
37: Wear suitable gloves
39: Wear eye/face protection
3-(Dibutylamino)propionitrile ,its CAS NO. is 25726-99-2,the synonyms is 4-04-00-02543 (Beilstein Handbook Reference) ; AI3-32937 ; BRN 1705000 ; EINECS 247-211-6 ; N,N-Dibutyl-3-aminopropionitrile ; NSC 62640 ; 3-Bis(N-n-butyl)aminopropiononitrile ; Propanenitrile, 3-(dibutylamino)- (9CI) ; Propionitrile, 3-(dibutylamino)- (6CI,7CI,8CI) ; Propionitrile, 3-amino-N,N-dibutyl- .