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852227-88-4

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Basic Information
CAS No.: 852227-88-4
Name: N-[(1,5-DIMETHYL-1H-PYRAZOL-3-YL)METHYL]-N-METHYLAMINE
Molecular Structure:
Molecular Structure of 852227-88-4 (N-[(1,5-DIMETHYL-1H-PYRAZOL-3-YL)METHYL]-N-METHYLAMINE)
Formula: C7H13N3
Molecular Weight: 139.2
Synonyms: 1,5-Dimethyl-1H-pyrazol-3-ylmethyl)-methyl-amine;
Density: 1.03 g/cm3
Boiling Point: 216.9 °C at 760 mmHg
Flash Point: 85 °C
Risk Codes: 34
Safety: 26-36/37/39-45
PSA: 29.85000
LogP: 0.83880
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Specification

The 1H-Pyrazole-3-methanamine,N,1,5-trimethyl-, with the CAS registry number 852227-88-4, is also known as (1,5-Dimethyl-1H-pyrazol-3-ylmethyl)-methyl-amine. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C7H13N3 and molecular weight is 139.2. What's more, its systematic name is called 1-(1,5-Dimethyl-1H-pyrazol-3-yl)-N-methylmethanamine.

Physical properties about 1H-Pyrazole-3-methanamine,N,1,5-trimethyl- are: (1) ACD/LogP: -0.07; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 3; (4) #H bond donors: 1; (5) #Freely Rotating Bonds: 2; (6) Polar Surface Area: 21.06 Å2; (7) Index of Refraction: 1.535; (8) Molar Refractivity: 41.76 cm3; (9) Molar Volume: 134.1 cm3; (10) Surface Tension: 32.7 dyne/cm; (11) Density: 1.03 g/cm3; (12) Flash Point: 85 °C; (13) Enthalpy of Vaporization: 45.33 kJ/mol; (14) Boiling Point: 216.9 °C at 760 mmHg; (15) Vapour Pressure: 0.137 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1c(cc(n1C)C)CNC
(2) InChI: InChI=1/C7H13N3/c1-6-4-7(5-8-2)9-10(6)3/h4,8H,5H2,1-3H3
(3) InChIKey: CUUKYAXSSNWKLV-UHFFFAOYAL