Catalog Number |
ACM1079023-1 |
CAS |
1079-02-3 |
Structure |
|
Synonyms |
Benzenecarboxylic Acid |
IUPAC Name |
2,3,4,5,6-pentadeuteriobenzoic acid |
Molecular Weight |
127.15 |
Molecular Formula |
C6D5COOH |
InChI |
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D,2D,3D,4D,5D |
InChI Key |
WPYMKLBDIGXBTP-RALIUCGRSA-N |
Boiling Point |
249 °C (lit.) |
Melting Point |
121-125 °C (lit.) |
Appearance |
White to light beige fine crystalline powder |
Chemical Formula |
C6D5COOH |
Functional Group |
Carboxylic Acids & Salts |
Hazards |
Non-hazardous for transport. |
Isomeric SMILES |
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)O)[2H])[2H] |
Isotopic Enrichment |
99 atom % D |
Packaging |
5 g In Stock |
Shipping Hazards |
NON-HAZARDOUS FOR TRANSPORT |
Stability |
Stable if stored under recommended conditions (see section 7 of SDS). After three years, the compound should be re-analyzed for chemical purity before use. |
Storage Conditions |
Store at room temperature |
Unlabeled CAS |
65-85-0 |
Unlabeled Synonyms |
Benzenecarboxylic acid |