Home Other Building Blocks 1,3-Dihydroisobenzofuran

1,3-Dihydroisobenzofuran

CAS No.:
496-14-0
Catalog Number:
AG003DJV
Molecular Formula:
C8H8O
Molecular Weight:
120.1485
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>97.0%(GC)
1 week
United States
$116
- +
25g
>97.0%(GC)
1 week
United States
$257
- +
Product Description
Catalog Number:
AG003DJV
Chemical Name:
1,3-Dihydroisobenzofuran
CAS Number:
496-14-0
Molecular Formula:
C8H8O
Molecular Weight:
120.1485
MDL Number:
MFCD00005932
IUPAC Name:
1,3-dihydro-2-benzofuran
InChI:
InChI=1S/C8H8O/c1-2-4-8-6-9-5-7(8)3-1/h1-4H,5-6H2
InChI Key:
SFLGSKRGOWRGBR-UHFFFAOYSA-N
SMILES:
O1Cc2c(C1)cccc2
EC Number:
207-815-2
UNII:
2R6NTQ7Y6G
Properties
Complexity:
88.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.058g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
120.151g/mol
Monoisotopic Mass:
120.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Highly stereoselective chemoenzymatic synthesis of the 3H-isobenzofuran skeleton. Access to enantiopure 3-methylphthalides. Organic letters 20120316
The use of endophytes to obtain bioactive compounds and their application in biotransformation process. Biotechnology research international 20110101
Antioxidant Activity of Aspergillus fumigatus. ISRN pharmacology 20110101
Isolation and identification of FR198248, a hydroxylated 1,3-dihydroisobenzofuran, from Aspergillus flavipes as an inhibitor of peptide deformylase. Bioscience, biotechnology, and biochemistry 20100101
Zero order spectrophotometric method for estimation of escitalopram oxalate in tablet formulations. Journal of young pharmacists : JYP 20100101
Synthesis and anticancer activity of sclerophytin-inspired hydroisobenzofurans. Bioorganic & medicinal chemistry letters 20091215
A novel chelatofore functionalized spiropyran of the 2-oxaindane series. Acta crystallographica. Section C, Crystal structure communications 20091201
Asymmetric synthesis of (+)-polyanthellin A. Journal of the American Chemical Society 20090805
2-[2-(Hydroxy-meth-yl)phen-yl]-1-phenyl-ethanol. Acta crystallographica. Section E, Structure reports online 20090201
Spectrophotometric method for simultaneous estimation of escitalopram oxalate and clonazepam in tablet dosage form. Indian journal of pharmaceutical sciences 20090101
Toward prediction of alkane/water partition coefficients. Journal of medicinal chemistry 20080710
An intramolecular Diels-Alder strategy for the asbestinins: enantioselective total syntheses of 11-acetoxy-4-deoxyasbestinin D and asbestinin-12. The Journal of organic chemistry 20080307
Fluorescence and ultraviolet absorption spectra and structure of coumaran and its ring-puckering potential energy function in the S1(pi,pi*) excited state. The Journal of chemical physics 20060721
Solid-supported [2+2+2] cyclotrimerizations. Chemistry (Weinheim an der Bergstrasse, Germany) 20060717
Toward a general route to the eunicellin diterpenes: the asymmetric total synthesis of deacetoxyalcyonin acetate. Journal of the American Chemical Society 20040218
1,3-dihydrobenzo[c]furan nucleoside analogues: additional studies of the thymine derivative. Bioorganic & medicinal chemistry letters 20031215
Electrospray tandem mass-spectrometric analysis of diastereo- and stereoisomeric pyrimidine nucleoside analogues based on the 1,3-dihydrobenzo[c]furan core. Carbohydrate research 20031031
Synthesis, stability, and biological evaluation of 1,3-dihydrobenzo[c]furan analogue of d4T and its SATE pronucleotide. Nucleosides, nucleotides & nucleic acids 20030101
Properties