| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 15 | Yes |
Popular Name: 1,2,3-Benzenetricarboxylic acid 1,2,3-Benzenetricarboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 36362-97-7 , 569-51-7 , 732304-21-1 , [36362-97-7] , [569-51-7]
1,2,3-Benzenetricarboxylic acid dihydrate
1,2,3-Benzenetricarboxylic acid dihydrate, 99%
1,2,3-Benzenetricarboxylic acid hydrate
1,2,3-Benzenetricarboxylic acid;Hemimellitic acid
1,2,3-BenzenetricarboxylicAcid
1,2,3-benzenetricarboxylicacidhydrate
Benzene-1,2,3-tricarboxylic acid
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.56 | 6.84 | -234.53 | 0 | 6 | -3 | 120 | 207.117 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 4.72 | -110.48 | 1 | 6 | -2 | 118 | 208.125 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 99% | APIChem |
| Melting_Point | ca 191? dec. | Alfa-Aesar |
| Melting_Point | ca 191° dec. | Alfa-Aesar |
| MP | ~195° (dec.) | Oakwood Chemical |
