In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2005 | 10 | Yes |
Popular Name: 5-Hydroxymethyl-2-furancarboxylic acid 5-Hydroxymethyl-2-furancarboxyli…
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CAS Numbers: 6338-41-6 , [6338-41-6]
5-(hydroxymethyl)-2-furoic acid
5-(Hydroxymethyl)furan-2-carboxylic acid
5-(hydroxymethyl)furan-2-carboxylicacid
5-Hydroxymethyl-2-furoate; 5-Hydroxymethyl-2-furoic acid; 6338-41-6; C20448
5-Hydroxymethyl-furan-2-carboxylic 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) | 0.34 | 0.85 | -51.19 | 1 | 4 | -1 | 73 | 141.102 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 164 - 166 | Enamine Building Blocks |
MP | 164...166 | Enamine Building Blocks |
MP | 165° | Matrix Scientific |
MP | 168-169° | Oakwood Chemical |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |