UCSF

ZINC32191994

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 13 Yes

Popular Name: methyl 4-fluoro-3-methoxybenzoate methyl 4-fluoro-3-methoxybenzoate

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CAS Numbers: 74385-37-8 , [74385-37-8]

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) 2.26 4.52 -6.73 0 3 0 36 184.166 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 69 - 71 KeyOrganics
MP 69-71° Matrix Scientific
Warnings IRRITANT Matrix Scientific

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