Tribenzylamine - CAS 620-40-6
Catalog: |
BB031395 |
Product Name: |
Tribenzylamine |
CAS: |
620-40-6 |
Synonyms: |
N,N-dibenzyl-1-phenylmethanamine |
IUPAC Name: | N,N-dibenzyl-1-phenylmethanamine |
Description: | Tribenzylamine (CAS# 620-40-6) is a useful research chemical. |
Molecular Weight: | 287.40 |
Molecular Formula: | C21H21N |
Canonical SMILES: | C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC3=CC=CC=C3 |
InChI: | InChI=1S/C21H21N/c1-4-10-19(11-5-1)16-22(17-20-12-6-2-7-13-20)18-21-14-8-3-9-15-21/h1-15H,16-18H2 |
InChI Key: | MXHTZQSKTCCMFG-UHFFFAOYSA-N |
Boiling Point: | 380-390 °C |
Density: | 0.9913 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00004773 |
LogP: | 4.88900 |
GHS Hazard Statement: | H315 (99.86%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22271403 | 20120227 | Visible-light-induced selective photocatalytic aerobic oxidation of amines into imines on TiO2 | Chemistry (Weinheim an der Bergstrasse, Germany) |
21271707 | 20110304 | Multiple hindered rotators in a gyroscope-inspired tribenzylamine hemicryptophane | The Journal of organic chemistry |
20162128 | 20100307 | Self-assembly of tris(ureidobenzyl)amines: flexible bricks for robust architectures | Chemical communications (Cambridge, England) |
21580276 | 20100227 | 3-Phenyl-pyridinium tetra-chlorido-aurate(III) | Acta crystallographica. Section E, Structure reports online |
21579674 | 20100130 | Bis(tribenzyl-ammonium) tetra-chloridoaurate(III) chloride | Acta crystallographica. Section E, Structure reports online |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 287.167399674 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 287.167399674 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 3.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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