UCSF

ZINC00157240

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 10 No

Popular Name: 4-Fluoro-3-methylbenzaldehyde 4-Fluoro-3-methylbenzaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 135427-08-6 , [135427-08-6]

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) 2.27 2.62 -6.67 0 1 0 17 138.141 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 208? Alfa-Aesar
Boiling_Point 208° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific
Purity ¡Ý99% APIChem

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