In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 23 | No |
Popular Name: 4-[(4-Methyl-benzylamino)-methyl]-3-nitro-benzoicacid methyl ester 4-[(4-Methyl-benzylamino)-methyl…
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CAS Number: 675602-57-0
4-[(4-Methyl-benzylamino)-methyl]-3-nitro-benzoic
4-[(4-Methyl-benzylamino)-methyl]-3-nitro-benzoic acid methyl ester
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) | 3.40 | 2.23 | -55.56 | 2 | 6 | 1 | 88 | 315.349 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 97% | Fluorochem |