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74299-91-5,MFCD00013994
Catalog No.:AA005CD7
74299-91-5 | Benzoic acid, 4,4'-(1E)-1,2-ethenediylbis-
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  • Technical Information
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Technical Information
Catalog Number:
AA005CD7
Chemical Name:
Benzoic acid, 4,4'-(1E)-1,2-ethenediylbis-
CAS Number:
74299-91-5
Molecular Formula:
C16H12O4
Molecular Weight:
268.2641
MDL Number:
MFCD00013994
IUPAC Name:
4-[2-(4-carboxyphenyl)ethenyl]benzoic acid
InChI:
InChI=1S/C16H12O4/c17-15(18)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(19)20/h1-10H,(H,17,18)(H,19,20)
InChI Key:
SBBQDUFLZGOASY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)/C=C/c1ccc(cc1)C(=O)O
Properties
Computed Properties
 
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.074g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.268g/mol
Monoisotopic Mass:
268.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

Synonyms
 
4,4-Stilbenedicarboxylic Acid 
133005-88-6 
SBBQDUFLZGOASY-UHFFFAOYSA-N 
ANW-14230 
4,4'-STILBENEDICARBOXYLICACID 
MCULE-6294593331 
TRA0040078 
4-[2-(4-carboxyphenyl)ethenyl]benzoic acid 
FT-0617119 
FT-0623949 
S0557 
Benzoic acid, 4,4'-(1E)-1,2-ethenediylbis- 
CIS-STILBENE-4,4'-DICARBOXYLIC ACID 
74299-91-5 
4,4'-Stilbenedicarboxylic acid 
Stilbene-4,4'-dicarboxylic acid 
C16H12O4 
CID97794 
100-31-2 
4,4'-(Ethene-1,2-diyl)dibenzoic acid 
(Z)-4,4'-(Ethene-1,2-diyl)dibenzoic acid 
ACMC-1BEGJ 
AC1L3Z9I 
KSC174M4D 
CTK0H4641 
CTK2H0318 
CTK4B8291 
KS-00000UDD 
Literature

Title: The impact of E-Z photo-isomerization on single molecular conductance.

Journal: Nano letters 20100609

Title: catena-Poly[[[aqua-(pyrazino[2,3-f][1,10]phenanthroline)cadium(II)]-μ-4,4'-ethyl-enedibenzoato] N,N-dimethyl-formamide hemisolvate].

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Title: Distinct differences in self-assembly of aromatic linear dicarboxylic acids.

Journal: Langmuir : the ACS journal of surfaces and colloids 20090120

Title: Poly[bis-(N,N-dimethyl-formamide)tris-(μ(4)-trans-stilbene-4,4'-dicarboxyl-ato)-tricadmium(II)]: a two-dimensional network with an unusual 3 topology.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: The photochemistry of some main chain liquid crystalline 4,4'-stilbene dicarboxylate polyesters.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20080501

Title: Towards tuning the packing and entanglement of zigzag coordination chains by terminal ligands.

Journal: Dalton transactions (Cambridge, England : 2003) 20080421

Title: Reversible photoswitchable wettability in noncovalently assembled multilayered films.

Journal: Langmuir : the ACS journal of surfaces and colloids 20071218

Title: Influence of connectivity and porosity on ligand-based luminescence in zinc metal-organic frameworks.

Journal: Journal of the American Chemical Society 20070606

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