UCSF

ZINC39212361

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2010 10 No

Popular Name: 5-Chloro-2-methylbenzaldehyde 5-Chloro-2-methylbenzaldehyde

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CAS Numbers: 58966-34-0 , [58966-34-0]

Other Names:

F2150-0019

MFCD11111042

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) 2.78 5.28 -7.01 0 1 0 17 154.596 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

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

No pre-computed analogs available. Try a structural similarity search.