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Safety Information

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:
632-46-2
Molecular Weight:
150.17
Beilstein:
1863791
EC Number:
211-177-0
MDL number:
MFCD00002483
UNSPSC Code:
12352100
PubChem Substance ID:
24849646
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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

156906-1G:
156906-10G:
156906-BULK:
156906-VAR:
156906-5G:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCK9201
SHBK4590
WXBC8457V
11916CH
03129CA

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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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