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17383

Sigma-Aldrich

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:
4435-67-0
Molecular Weight:
252.22
Beilstein:
9300288
MDL number:
MFCD03095533
UNSPSC Code:
12352100
PubChem Substance ID:
57647650
NACRES:
NA.22

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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

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Benzene-1,3,5-triacetic acid ≥97.0% (T)

17383

Benzene-1,3,5-triacetic acid

1,3,5-Phenyltriboronic acid, tris(pinacol) ester ≥97%

900989

1,3,5-Phenyltriboronic acid, tris(pinacol) ester

1,3,5-Tris(2-methylphenyl)benzene 97%

764671

1,3,5-Tris(2-methylphenyl)benzene

Nitrilotriacetic acid ACS reagent, ≥99.0%

72560

Nitrilotriacetic acid

form

powder

form

powder or crystals

form

solid

form

powder

functional group

carboxylic acid

functional group

-

functional group

-

functional group

amine, carboxylic acid

Other Notes

Building block and core molecule for generating diverse libraries in combinatorial chemistry[1]; preparation of giant propeller molecules[2][3][4]

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H319

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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    BGBC4700V
    1437232V
    1437232
    1424922
    063668/1

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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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