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318280-95-4

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Basic Information
CAS No.: 318280-95-4
Name: N-METHYL-N-PHENYL-2-PIPERAZIN-1-YLACETAMIDE
Article Data: 2
Molecular Structure:
Molecular Structure of 318280-95-4 (N-METHYL-N-PHENYL-2-PIPERAZIN-1-YLACETAMIDE)
Formula: C13H19N3O
Molecular Weight: 233.313
Synonyms: N-(2-Piperazino-acetyl)-N-methylaniline;N-Methyl-N-phenyl-2-piperazin-1-ylacetamide;2-(Piperazin-1-yl)-acetic acid N-methyl-N-phenyl-amide;N-Methyl-N-phenyl-2-piperazinylacetamide;
Density: 1.107 g/cm3
Melting Point: 68-70 °C
Boiling Point: 365.7 °C at 760 mmHg
Flash Point: 175 °C
Hazard Symbols: Xi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 35.58000
LogP: 0.82130
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Specification

The 1-Piperazineacetamide,N-methyl-N-phenyl-, with the CAS registry number 318280-95-4, is also known as N-(2-Piperazino-acetyl)-N-methylaniline. This chemical's molecular formula is C13H19N3O and molecular weight is 233.31. What's more, its systematic name is N-Methyl-N-phenyl-2-piperazin-1-ylacetamide.

Physical properties of 1-Piperazineacetamide,N-methyl-N-phenyl- are: (1)ACD/LogP: 1.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.71; (4)ACD/LogD (pH 7.4): -0.19; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 4.63; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.79 Å2; (13)Index of Refraction: 1.564; (14)Molar Refractivity: 68.6 cm3; (15)Molar Volume: 210.6 cm3; (16)Polarizability: 27.19×10-24 cm3; (17)Surface Tension: 43.4 dyne/cm; (18)Density: 1.107 g/cm3; (19)Flash Point: 175 °C; (20)Enthalpy of Vaporization: 61.2 kJ/mol; (21)Boiling Point: 365.7 °C at 760 mmHg; (22)Vapour Pressure: 1.54E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C1=CC=CC=C1)C(=O)CN2CCNCC2 (2)InChI: InChI=1S/C13H19N3O/c1-15(12-5-3-2-4-6-12)13(17)11-16-9-7-14-8-10-16/h2-6,14H,7-11H2,1H3
(3)InChIKey: IAZRIFOHJXNFPA-UHFFFAOYSA-N