Home Other Building Blocks 1,4-Diacetoxybenzene

1,4-Diacetoxybenzene

CAS No.:
1205-91-0
Catalog Number:
AG003B0K
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%forsynthesis
In Stock USA
United States
$40
- +
25g
95%forsynthesis
In Stock USA
United States
$69
- +
100g
95%forsynthesis
In Stock USA
United States
$143
- +
500g
95%forsynthesis
In Stock USA
United States
$380
- +
Product Description
Catalog Number:
AG003B0K
Chemical Name:
1,4-Diacetoxybenzene
CAS Number:
1205-91-0
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00011643
IUPAC Name:
(4-acetyloxyphenyl) acetate
InChI:
InChI=1S/C10H10O4/c1-7(11)13-9-3-5-10(6-4-9)14-8(2)12/h3-6H,1-2H3
InChI Key:
AKOGNYJNGMLDOA-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(cc1)OC(=O)C
EC Number:
214-887-9
UNII:
18I4277Z6G
NSC Number:
9277
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Poly[[μ2-1,3-bis(pyridin-4-yl)propane](μ3-1,4-phenylenediacetato)cadmium]. Acta crystallographica. Section C, Crystal structure communications 20120201
catena-Poly[[(triaqua-cadmium)-μ-1,4-phenyl-enediacetato-κO,O':O'',O'''] dihydrate]. Acta crystallographica. Section E, Structure reports online 20111201
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Highly luminescent and triboluminescent coordination polymers assembled from lanthanide β-diketonates and aromatic bidentate O-donor ligands. Inorganic chemistry 20101018
4,4'-Bipyridinium 1,4-phenyl-ene-diacetate. Acta crystallographica. Section E, Structure reports online 20091001
A novel nickel(II) coordination polymer incorporating 1,4-phenylenediacetic acid and 1,10-phenanthroline. Acta crystallographica. Section C, Crystal structure communications 20060201
A new chain-like cadmium(II) coordination polymer containing chains of water molecules. Acta crystallographica. Section C, Crystal structure communications 20050601
Connecting pairs of dimetal units to form molecular loops. Inorganic chemistry 20010129
Properties