CAS 77354-98-4 | Benzaldehyde,2,2'-[1,4-butanediylbis(oxy)]bis- | CAS Number 77354-98-4

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77354-98-4 | Benzaldehyde,2,2'-[1,4-butanediylbis(oxy)]bis-

CAS No: 77354-98-4 Catalog No: AG008N4V MDL No:

Product Description

Catalog Number:

AG008N4V

Chemical Name:

Benzaldehyde,2,2'-[1,4-butanediylbis(oxy)]bis-

CAS Number:

77354-98-4

Molecular Formula:

C18H18O4

Molecular Weight:

298.3331

IUPAC Name:

2-[4-(2-formylphenoxy)butoxy]benzaldehyde

InChI:

InChI=1S/C18H18O4/c19-13-15-7-1-3-9-17(15)21-11-5-6-12-22-18-10-4-2-8-16(18)14-20/h1-4,7-10,13-14H,5-6,11-12H2

InChI Key:

WNEFNKQASOEBOX-UHFFFAOYSA-N

SMILES:

O=Cc1ccccc1OCCCCOc1ccccc1C=O

Properties

Complexity:

299

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

298.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.338g/mol

Monoisotopic Mass:

298.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
2-[4-(2-Formyl-phen-oxy)-but-oxy]-benzaldehyde.	Acta crystallographica. Section E, Structure reports online 20110901
Chiral polymers containing a carbohydrate moiety: synthesis.	Macromolecular bioscience 20040419
The formation of a cyclic diacetal of methyl alpha-D-mannopyranoside with a 16-membered macrocyclic loop.	Chemical communications (Cambridge, England) 20020507