4,4'-Bis[ (E) -2-methoxystyryl]biphenyl

CAT: 0127-OR1077632Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1077632Size:25 g

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CAS Number

79448-61-6

Purity

>90.0%

Smiles

COC1=CC=CC=C1C=CC2=CC=C (C=C2) C3=CC=C (C=C3) C=CC4=CC=CC=C4OC

Chemical Information

1,1'-Biphenyl, 4,4'-bis[2-(2-methoxyphenyl)ethenyl]-

See also: 4,4'-Bis(2-(2-methoxyphenyl)ethenyl)-1,1'-biphenyl (annotation moved to).

CAS Number	79448-61-6
PubChem CID	6441620
IUPAC Name	1-methoxy-2-[(E)-2-[4-[4-[(E)-2-(2-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
Molecular Formula	C30H26O2
Molecular Weight	418.5
XLogP	8
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Heavy Atom Count	32
Formal Charge	0
Complexity	528

SMILES

COC1=CC=CC=C1/C=C/C2=CC=C(C=C2)C3=CC=C(C=C3)/C=C/C4=CC=CC=C4OC

InChI

InChI=1S/C30H26O2/c1-31-29-9-5-3-7-27(29)21-15-23-11-17-25(18-12-23)26-19-13-24(14-20-26)16-22-28-8-4-6-10-30(28)32-2/h3-22H,1-2H3/b21-15+,22-16+

InChIKey

HZAWHDJKNZWAAR-YHARCJFQSA-N

Chemical Structure

2D Structure

CAS: 79448-61-6

CID: 6441620

Formula: C30H26O2

MW: 418.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	418.5
XLogP3	8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	418.193280068
Monoisotopic Mass	418.193280068
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	528
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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