UCSF

ZINC00165062

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Substance Information

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

Popular Name: 2-Chloro-4-fluorobenzaldehyde 2-Chloro-4-fluorobenzaldehyde

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CAS Number: 84194-36-5

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) 2.50 2.22 -8.04 0 1 0 17 158.559 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 118-120?/50mm Alfa-Aesar
Boiling_Point 118-120°/50mm Alfa-Aesar
Melting_Point 60-63? Alfa-Aesar
Melting_Point 60-63° Alfa-Aesar
MP 61 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO1990002120A1 IBM Patent Data

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