17383
Benzene-1,3,5-triacetic acid
≥97.0% (T)
Synonym(s):
1,3,5-Tris(carboxymethyl)benzene
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About This Item
Empirical Formula (Hill Notation):
C12H12O6
CAS Number:
Molecular Weight:
252.22
Beilstein:
9300288
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
≥97.0% (T)
form
powder
functional group
carboxylic acid
SMILES string
OC(=O)Cc1cc(CC(O)=O)cc(CC(O)=O)c1
InChI
1S/C12H12O6/c13-10(14)4-7-1-8(5-11(15)16)3-9(2-7)6-12(17)18/h1-3H,4-6H2,(H,13,14)(H,15,16)(H,17,18)
InChI key
AJEIBHNKBLRDNT-UHFFFAOYSA-N
Other Notes
Building block and core molecule for generating diverse libraries in combinatorial chemistry; preparation of giant propeller molecules
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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J.S. Bradshaw et al.
Journal of Heterocyclic Chemistry, 35, 519-519 (1998)
T Carell et al.
Chemistry & biology, 2(3), 171-183 (1995-03-01)
The increasing interest in combinatorial chemistry as a tool for the development of therapeutics has led to many new methods of creating molecular libraries of potential lead compounds. Current methods have made it possible to develop libraries of several million
S. Brandl et al.
J. Prakt. Chem., 338, 451-451 (1996)
L. Tong et al.
Journal of the American Chemical Society, 119, 7291-7291 (1997)
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