UCSF

ZINC00167401

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: Ethyl 2-(5-amino-2-chloro-4-fluorophenoxy)acetate Ethyl 2-(5-amino-2-chloro-4-fluo…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 91920-52-4 , [91920-52-4]

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) 2.41 0.97 -10.34 2 4 0 61 247.653 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 7.600000000000000e+001 - 8.000000000000000e+001 KeyOrganics
melting_point 76 - 80 KeyOrganics
MP 76-80° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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