Benzenemethanamine, N-methyl-3-(5-pyrimidinyl)- supplier

Name
N-METHYL-N-(3-PYRIMIDIN-5-YLBENZYL)AMINE
EINECS
CAS No. 852431-03-9
Density 1.089 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₃N₃
Boiling Point 341.6 °C at 760 mmHg
Molecular Weight 199.25
Flash Point 160.4 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 34
Molecular Structure
Hazard Symbols
Synonyms N-Methyl-3-(5-pyrimidinyl)benzylamine;N-[3-(Pyrimidin-5-yl)benzyl]-N-methylamine;
PSA 37.81000
LogP 2.25390

Benzenemethanamine, N-methyl-3-(5-pyrimidinyl)- Specification

The Benzenemethanamine, N-methyl-3-(5-pyrimidinyl)-, with the CAS registry number 852431-03-9, is also known as N-Methyl-N-(3-pyrimidin-5-ylbenzyl)amine. This chemical's molecular formula is C₁₂H₁₃N₃ and molecular weight is 199.25. What's more, its systematic name is called N-Methyl-1-(3-pyrimidin-5-ylphenyl)methanamine.

Physical properties about Benzenemethanamine, N-methyl-3-(5-pyrimidinyl)- are: (1) ACD/LogP: 0.73; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 3; (4) #H bond donors: 1; (5) #Freely Rotating Bonds: 3; (6) Polar Surface Area: 29.02 Å²; (7) Index of Refraction: 1.572; (8) Molar Refractivity: 60.17 cm³; (9) Molar Volume: 182.7 cm³; (10) Surface Tension: 45 dyne/cm; (11) Density: 1.089 g/cm³; (12) Flash Point: 160.4 °C; (13) Enthalpy of Vaporization: 58.53 kJ/mol; (14) Boiling Point: 341.6 °C at 760 mmHg; (15) Vapour Pressure: 7.93E-05 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. And in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: n2cc(c1cc(ccc1)CNC)cnc2
(2) InChI: InChI=1/C12H13N3/c1-13-6-10-3-2-4-11(5-10)12-7-14-9-15-8-12/h2-5,7-9,13H,6H2,1H3
(3) InChIKey: AKWRDWWCLOUCIB-UHFFFAOYAH

Product Name

N-METHYL-N-(3-PYRIMIDIN-5-YLBENZYL)AMINE

Benzenemethanamine, N-methyl-3-(5-pyrimidinyl)- Specification

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