UCSF

ZINC02566480

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 Yes

Popular Name: 2-Fluoro-4-methoxybenzoic acid 2-Fluoro-4-methoxybenzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 321-24-4 , 394-42-3

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) 1.66 3.44 -51.07 0 3 -1 49 169.131 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 191 - 193 Enamine Building Blocks
MP 191...193 Enamine Building Blocks
Melting_Point 192-198? Alfa-Aesar
Melting_Point 192-198° Alfa-Aesar
MP 193 TCI
MP 193.5-195.5° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 96% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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