7567-63-7 | 1,3,5-Triethynylbenzene

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$7.00	$5.00
1g	95%	in stock	$10.00	$7.00
5g	95%	in stock	$44.00	$31.00
100g	95%	in stock	$844.00	$591.00

Description

• Catalog Number: AB43120
• Chemical Name: 1,3,5-Triethynylbenzene
• CAS Number: 7567-63-7
• Molecular Formula: C12H6
• Molecular Weight: 150.1760
• MDL Number: MFCD00068621
• SMILES: C#Cc1cc(C#C)cc(c1)C#C

Computed Properties

• Complexity: 230
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Rotatable Bond Count: 3
• XLogP3: 2.7

Literature

• Topological and electronic influences on magnetic exchange coupling in Fe(III) ethynylbenzene dendritic building blocks.

  Journal of the American Chemical Society 20111228

• Crystallographic coincidence of two bridging species in a dinuclear Co ethynyl-benzene complex.

  Acta crystallographica. Section E, Structure reports online 20110701

• The role of the ethynyl substituent on the π-π stacking affinity of benzene: a theoretical study.

  Chemphyschem : a European journal of chemical physics and physical chemistry 20110207

• Counterintuitive substituent effect of the ethynyl group in ion-pi interactions.

  The journal of physical chemistry. A 20090924

• Conjugated microporous poly(phenylene butadiynylene)s.

  Chemical communications (Cambridge, England) 20080128

• Rigid molecular architectures that comprise a 1,3,5-trisubstituted benzene core and three oligoaryleneethynylene arms: light-emitting characteristics and pi conjugation between the arms.

  Journal of the American Chemical Society 20060412

• Convergent synthesis of platinum-acetylide dendrimers.

  Chemistry (Weinheim an der Bergstrasse, Germany) 20041203

• Synthesis of linear and tripoidal oligo(phenylene ethynylene)-based building blocks for application in modular DNA-programmed assembly.

  The Journal of organic chemistry 20040402