Name: Name:1,1':3',1''-Terphenyl, 4,4''-diethynyl-5'-(4-ethynylphenyl)-
Brand: Angene
SKU: AG005FC3
Rating: 90 (10 reviews)

1,1':3',1''-Terphenyl, 4,4''-diethynyl-5'-(4-ethynylphenyl)-

CAS No.:

71866-86-9

Catalog Number:

AG005FC3

Molecular Formula:

C30H18

Molecular Weight:

378.4639

Catalog Number:

AG005FC3

Chemical Name:

1,1':3',1''-Terphenyl, 4,4''-diethynyl-5'-(4-ethynylphenyl)-

CAS Number:

71866-86-9

Molecular Formula:

C30H18

Molecular Weight:

378.4639

MDL Number:

MFCD00344835

IUPAC Name:

1,3,5-tris(4-ethynylphenyl)benzene

InChI:

InChI=1S/C30H18/c1-4-22-7-13-25(14-8-22)28-19-29(26-15-9-23(5-2)10-16-26)21-30(20-28)27-17-11-24(6-3)12-18-27/h1-3,7-21H

InChI Key:

XJIJQOFZIULKCI-UHFFFAOYSA-N

SMILES:

C#Cc1ccc(cc1)c1cc(cc(c1)c1ccc(cc1)C#C)c1ccc(cc1)C#C

Complexity:

579

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

378.141g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

378.474g/mol

Monoisotopic Mass:

378.141g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.5