1H-Imidazole-4-methanamine,1-(triphenylmethyl)- supplier

Name
C-(1-TRITYL-1H-IMIDAZOL-4-YL)-METHYLAMINE
EINECS
CAS No. 340179-89-7
Density 1.108 g/cm³
Solubility
Melting Point
Formula C₂₃H₂₁N₃
Boiling Point 505.43 °C at 760 mmHg
Molecular Weight 339.44
Flash Point 259.475 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (1-Trityl-1H-imidazol-4-yl)methylamine;(1-Tritylimidazol-4-yl)methanamine;
PSA 43.84000
LogP 4.88230

1H-Imidazole-4-methanamine,1-(triphenylmethyl)- Specification

The 1H-Imidazole-4-methanamine,1-(triphenylmethyl)-, with the CAS registry number 340179-89-7, is also known as (1-Trityl-1H-imidazol-4-yl)methylamine. This chemical's molecular formula is C₂₃H₂₁N₃ and molecular weight is 339.43. What's more, its IUPAC name is (1-tritylimidazol-4-yl)methanamine.

Physical properties of 1H-Imidazole-4-methanamine,1-(triphenylmethyl)- are: (1)ACD/LogP: 3.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.577; (4)ACD/LogD (pH 7.4): 2.281; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 20.512; (7)ACD/KOC (pH 5.5): 3.541; (8)ACD/KOC (pH 7.4): 179.308; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 43.84 Å²; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 107.808 cm³; (15)Molar Volume: 306.326 cm³; (16)Polarizability: 42.739×10^-24cm³; (17)Surface Tension: 46.315 dyne/cm; (18)Density: 1.108 g/cm³; (19)Flash Point: 259.475 °C; (20)Enthalpy of Vaporization: 77.51 kJ/mol; (21)Boiling Point: 505.43 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)CN
(2)InChI: InChI=1S/C23H21N3/c24-16-22-17-26(18-25-22)23(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,17-18H,16,24H2
(3)InChIKey: LSNOXFPGBSGJIK-UHFFFAOYSA-N

Product Name

C-(1-TRITYL-1H-IMIDAZOL-4-YL)-METHYLAMINE

1H-Imidazole-4-methanamine,1-(triphenylmethyl)- Specification

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