UCSF

ZINC03847167

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 13 Yes

Popular Name: 6-Methylsalicylic acid ethyl ester 6-Methylsalicylic acid ethyl ester

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CAS Numbers: 6555-40-4 , 6575-09-3 , [6555-40-4]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 2.49 0.54 -8.03 1 3 0 47 180.203 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 45 TCI
MP 45° Oakwood Chemical
Purity 95% Fluorochem

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Analogs ( Draw Identity 99% 90% 80% 70% )