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626-19-7 | Isophthaldehyde
CAS No: 626-19-7 Catalog No: AG0035A0 MDL No:MFCD00003372
Product Description
Catalog Number:
AG0035A0
Chemical Name:
Isophthaldehyde
CAS Number:
626-19-7
Molecular Formula:
C8H6O2
Molecular Weight:
134.1320
MDL Number:
MFCD00003372
IUPAC Name:
benzene-1,3-dicarbaldehyde
InChI:
InChI=1S/C8H6O2/c9-5-7-2-1-3-8(4-7)6-10/h1-6H
InChI Key:
IZALUMVGBVKPJD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)C=O
EC Number:
210-935-8
UNII:
LU162B2N9X
NSC Number:
5092
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.037g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.134g/mol
Monoisotopic Mass:
134.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| A new bis(rhodamine)-based fluorescent chemosensor for Fe3+. | Journal of fluorescence 20120501 |
| Ligand influence over the formation of dinuclear [2+2] versus trinuclear [3+3] Cu(I) Schiff base macrocyclic complexes. | Inorganic chemistry 20110801 |
| 1,3-Bis[(-)-(S)-(1-phenyl-eth-yl)imino-meth-yl]benzene. | Acta crystallographica. Section E, Structure reports online 20110701 |
| Fluoride: solution- and solid-state structural binding probe. | The Journal of organic chemistry 20100115 |
| Synthesis and Characterization of New Optically Active Poly (ethyl L-lysinamide)s and Poly (ethyl L-lysinimide)s. | Journal of amino acids 20100101 |
| 1,3-Bis{(+)-(S)-[1-(1-naphth-yl)eth-yl]imino-meth-yl}benzene dichloro-methane solvate. | Acta crystallographica. Section E, Structure reports online 20090601 |
| Novel dimeric cholesteryl-based A(LS)2 low-molecular-mass gelators with a benzene ring in the linker. | Journal of colloid and interface science 20081101 |
| Spherical versus linear anion encapsulation in the cavity of a protonated azacryptand. | Inorganic chemistry 20080915 |
| Equilibrium constants in reactions of 2-aminoethanol and ammonia with isophthalaldehyde and terephthalaldehyde. | The journal of physical chemistry. A 20071220 |
| Ground-state, excited-singlet-state, and excited-triplet-state energy levels and photophysics of the three rotational isomers of isophthalaldehyde vapor. | The journal of physical chemistry. A 20070830 |
| Matrix-isolation infrared spectroscopy of the rotational isomers of 1,2-, 1,3-, and 1,4-benzenedicarboxaldehyde. | The journal of physical chemistry. A 20070802 |
| Regioselective 15-bromination and functionalization of a stable synthetic bacteriochlorin. | The Journal of organic chemistry 20070706 |
| Unprecedented selectivity in the formation of large-ring oligoimines from conformationally bistable chiral diamines. | Organic letters 20060706 |
| Reverse thermo-responsive poly(ethylene oxide) and poly(propylene oxide) multiblock copolymers. | Biomaterials 20050201 |
| Oxidation of heterocyclic and aromatic aldehydes to the corresponding carboxylic acids by Acetobacter and Serratia strains. | Biotechnology letters 20041101 |
| A study on oxygen insertion in dinuclear silver cryptates. | Dalton transactions (Cambridge, England : 2003) 20040407 |
| Molecular dynamics study of 2rotaxanes: influence of solvation and cation on co-conformation. | The Journal of organic chemistry 20030613 |
| O- and m-Benzenedicarbaldehyde. | Acta crystallographica. Section C, Crystal structure communications 20021101 |
| Synthesis and effects on intracellular calcium of some 1,3-bis-(heteroaryl substituted)benzene derivatives. | Farmaco (Societa chimica italiana : 1989) 20020701 |
| Efficient intramolecular beta-mannoside formation using m-xylylene and isophthaloyl derivatives as rigid spacers. | Carbohydrate research 20020211 |
| Synthesis and liquid membrane transport properties of photolabile molecular clips based on dithiane-spiro-crown ethers. | Organic letters 20010823 |
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