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Name	N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine	EINECS	N/A
CAS No.	961-71-7	Density	1.038g/cm³
PSA	6.48000	LogP	3.25480
Solubility	N/A	Melting Point	N/A
Formula	C17H22 N2	Boiling Point	375.9°Cat760mmHg
Molecular Weight	254.375	Flash Point	166.2°C
Transport Information	N/A	Appearance	N/A
Safety	Poison by subcutaneous, intraperitoneal, and intramuscular routes. When heated to decomposition it emits toxic fumes of NO_x.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	1,2-Ethanediamine,N,N-dimethyl-N'-phenyl-N'-(phenylmethyl)- (9CI); Ethylenediamine,N-benzyl-N',N'-dimethyl-N-phenyl- (7CI,8CI); 2339 RP; Antergan; Bridal;Dimetina; Lergitin; N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine; PM 245;Phenbenzamine	Article Data	7

N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine Chemical Properties

Molecule structure of N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine (CAS NO.961-71-7):

IUPAC Name: N-Benzyl-N',N'-dimethyl-N-phenylethane-1,2-diamine
Molecular Weight: 254.36998 g/mol
Molecular Formula: C₁₇H₂₂N₂
Density: 1.038 g/cm³
Boiling Point: 375.9 °C at 760 mmHg
Flash Point: 166.2 °C
Index of Refraction: 1.59
Molar Refractivity: 82.67 cm³
Molar Volume: 244.8 cm³
Polarizability: 32.77×10^-24 cm³
Surface Tension: 42.8 dyne/cm
Enthalpy of Vaporization: 62.35 kJ/mol
Vapour Pressure: 7.52E-06 mmHg at 25 °C
XLogP3: 3.7
H-Bond Acceptor: 2
Rotatable Bond Count: 6
Exact Mass: 254.178299
MonoIsotopic Mass: 254.178299
Topological Polar Surface Area: 6.5
Heavy Atom Count: 19
Complexity: 227
Canonical SMILES: CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=C2
InChI: InChI=1S/C17H22N2/c1-18(2)13-14-19(17-11-7-4-8-12-17)15-16-9-5-3-6-10-16/h3-12H,13-15H2,1-2H3
InChIKey: CHOBRHHOYQKCOU-UHFFFAOYSA-N

N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine Toxicity Data With Reference

1.	ipr-rat LDLo:120 mg/kg	BJPCAL British Journal of Pharmacology and Chemotherapy. 11 (1956),1.
2.	ims-rat LDLo:350 mg/kg	FRPSAX Farmaco, Edizione Scientifica. 13 (1958),3.
3.	ipr-mus LD50:170 mg/kg	FRPSAX Farmaco, Edizione Scientifica. 13 (1958),3.
4.	scu-mus LD50:400 mg/kg	BJPCAL British Journal of Pharmacology and Chemotherapy. 11 (1956),1.

N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine Safety Profile

Poison by subcutaneous, intraperitoneal, and intramuscular routes. When heated to decomposition it emits toxic fumes of NO_x.

N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine Specification

N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine (CAS NO.961-71-7) is also named as 2339 RP ; 4-12-00-02324 (Beilstein Handbook Reference) ; Antergan ; BRN 2738634 ; Bridal ; Dimetina ; Lergitin ; NCI-C60719 ; PM 245 ; PM245 ; Phenbenzamine ; RP 2339 ; 1,2-Ethanediamine, N,N-dimethyl-N'-phenyl-N'-(phenylmethyl)- ; 1,2-Ethanediamine, N,N-dimethyl-N'-phenyl-N'-(phenylmethyl)- . N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine (CAS NO.961-71-7) is liquid. N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides. N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine is toxic. Hazardous decomposition products. So the storage environment should be ventilate, low-temperature and dry. Keep N-Benzyl-N',N'-dimethyl-N-phenylethylenediamine separate from raw materials of food.

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