CAS No.2217-07-4,N,N-DI-N-PROPYLANILINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2217-07-4
Name:	N,N-DI-N-PROPYLANILINE
Article Data:	63

Formula:	C₁₂H₁₉N
Molecular Weight:	177.29
Synonyms:	Aniline,N,N-dipropyl- (6CI,7CI,8CI);Dipropylaniline;N,N-Dipropylaniline;N,N-Dipropylbenzenamine;N-Phenyldipropylamine;NSC 5689;
EINECS:	218-705-9
Density:	0.916g/cm³
Melting Point:	-45°C (estimate)
Boiling Point:	245 °C at 760 mmHg
Flash Point:	102.2 °C
Appearance:	clear brown liquid
Risk Codes:	36/37/38
Safety:	26-36
PSA:	3.24000
LogP:	3.31300

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Specification

The Benzenamine,N,N-dipropyl-, with CAS registry number 2217-07-4, has the systematic name of N,N-dipropylaniline. Besides this, it is also called N,N-Di-N-propylaniline. This chemical is a kind of clear brown liquid. And the chemical formula of this chemical is C₁₂H₁₉N. What's more, its EINECS is 218-705-9.

Physical properties of Benzenamine,N,N-dipropyl-: (1)ACD/LogP: 4.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.06; (4)ACD/LogD (pH 7.4): 4.44; (5)ACD/BCF (pH 5.5): 572.12; (6)ACD/BCF (pH 7.4): 1399.64; (7)ACD/KOC (pH 5.5): 2527.43; (8)ACD/KOC (pH 7.4): 6183.14; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.523; (14)Molar Refractivity: 59.09 cm³; (15)Molar Volume: 193.4 cm³; (16)Polarizability: 23.42×10^-24cm³; (17)Surface Tension: 34.3 dyne/cm; (18)Density: 0.916 g/cm³; (19)Flash Point: 102.2 °C; (20)Enthalpy of Vaporization: 48.21 kJ/mol; (21)Boiling Point: 245 °C at 760 mmHg; (22)Vapour Pressure: 0.0294 mmHg at 25°C.

Preparation: this chemical can be prepared by propionaldehyde and nitrobenzene. This reaction will need reagents acetic acid, platinum.

When you are using this chemical, please be cautious about it as the following:
The Benzenamine,N,N-dipropyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: N(c1ccccc1)(CCC)CCC
(2)InChI: InChI=1/C12H19N/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
(3)InChIKey: MMFBQHXDINNBMW-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C12H19N/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
(5)Std. InChIKey: MMFBQHXDINNBMW-UHFFFAOYSA-N