CAS 41424-11-7 | 4'-(HEXYLOXY)-4-BIPHENYLCARBONITRILE | CAS Number 41424-11-7

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41424-11-7 | 4'-(HEXYLOXY)-4-BIPHENYLCARBONITRILE

CAS No: 41424-11-7 Catalog No: AG00BXPJ MDL No:MFCD00134145

Product Description

Catalog Number:

AG00BXPJ

Chemical Name:

4'-(HEXYLOXY)-4-BIPHENYLCARBONITRILE

CAS Number:

41424-11-7

Molecular Formula:

C19H21NO

Molecular Weight:

279.3761

MDL Number:

MFCD00134145

IUPAC Name:

4-(4-hexoxyphenyl)benzonitrile

InChI:

InChI=1S/C19H21NO/c1-2-3-4-5-14-21-19-12-10-18(11-13-19)17-8-6-16(15-20)7-9-17/h6-13H,2-5,14H2,1H3

InChI Key:

YUYXUPYNSOFWFV-UHFFFAOYSA-N

SMILES:

CCCCCCOc1ccc(cc1)c1ccc(cc1)C#N

EC Number:

255-358-2

Properties

Complexity:

316

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.162g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.383g/mol

Monoisotopic Mass:

279.162g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

33A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.6

Literature

Title	Journal
Relationships between the morphology and thermoresponsive behavior in micro/nanostructured thermosetting matrixes containing a 4'-(hexyloxy)-4-biphenylcarbonitrile liquid crystal.	Langmuir : the ACS journal of surfaces and colloids 20081007
Behavior of the layer compression modulus as a function of frequency near the nematic-smectic-A and re-entrant nematic-smectic-A phase transitions.	The European physical journal. E, Soft matter 20040501