CAS 554-95-0 Trimesic acid - Materials / Alfa Chemistry

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Trimesic acid

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Catalog Number

ACM554950

Product Name

Trimesic acid

Structure

CAS

554-95-0

Category

Hydrogen Storage Materials

Synonyms

TrimesicAcid
BTC

Description

Trimesic acid (TMA), also known as 1,3,5-benzenetricarboxylic acid, has a self-organized 2D molecular network structure formed by intermolecular hydrogen bonds between the carboxylic acid residues in bulk crystals. TMA can be used in the synthesis of metal-organic frameworks (MOFs), which can be used as organic linkers potentially utilized in sensors.

IUPAC Name

benzene-1,3,5-tricarboxylic acid

Molecular Weight

210.14

Molecular Formula

C9H6O6

Canonical SMILES

C1=C(C=C(C=C1C(=O)O)C(=O)O)C(=O)O

InChI

1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)

InChI Key

QMKYBPDZANOJGF-UHFFFAOYSA-N

Melting Point

>300 °C (lit.)

Flash Point

Not applicable

Purity

>98.0%(T)

Solubility

0.13 M

Appearance

White to Light yellow powder to crystal

Storage

2-8°C

Complexity

237

Covalently-Bonded Unit Count

EC Number

209-077-7

Exact Mass

210.016438g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00002517

MeSH Entry Terms

1,3,5-benzenetricarboxylate;1,3,5-benzenetricarboxylic acid;benzene-1,3,5-carboxylic acid;trimesic acid;trimesic acid, monosodium salt;trimesic acid, trisodium salt

Monoisotopic Mass

210.016438g/mol

NSC Number

3998

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Rotatable Bond Count

Signal Word

Warning

UNII

OU36OO5MTN

XLogP3

0.5

MSDS

Download MSDS

COA

Download COA

Spec Sheet