UCSF

ZINC00331074

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: ethyl 4,6-dichloronicotinate ethyl 4,6-dichloronicotinate

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CAS Numbers: 40296-46-6 , [40296-46-6]

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) 2.54 1.05 -4.28 0 3 0 39 220.055 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 32 - 34 KeyOrganics
MP 32-34° Matrix Scientific
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 96% Fluorochem
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific

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