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Key Documents

156906

Sigma-Aldrich

2,6-Dimethylbenzoic acid

97%

Synonym(s):

vic.-m-Xylylic acid

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About This Item

Linear Formula:
(CH3)2C6H3CO2H
CAS Number:
Molecular Weight:
150.17
Beilstein:
1863791
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

solid

mp

114-116 °C (lit.)

functional group

carboxylic acid

SMILES string

Cc1cccc(C)c1C(O)=O

InChI

1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)

InChI key

HCBHQDKBSKYGCK-UHFFFAOYSA-N

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General description

Crystal structure of 2,6-dimethylbenzoic acid was studied by three-dimensional X-ray methods.

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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The crystal structure of 2, 6-dimethylbenzoic acid.
Anca R, et al.
Acta Crystallographica Section E, Structure Reports Online, 23(6), 1010-1016 (1967)
Marcin Poreba et al.
Cell death and differentiation, 26(2), 229-244 (2018-05-12)
Apical caspases initiate and effector caspases execute apoptosis. Reagents that can distinguish between caspases, particularly apical caspases-8, 9, and 10 are scarce and generally nonspecific. Based upon a previously described large-scale screen of peptide-based caspase substrates termed HyCoSuL, we sought

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