UCSF

ZINC00169558

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 No

Popular Name: ethyl 2-(2-formylphenoxy)acetate ethyl 2-(2-formylphenoxy)acetate

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CAS Numbers: 41873-61-4 , [41873-61-4]

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) 1.97 7.08 -15.73 0 4 0 53 208.213 6 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 4.500000000000000e+001 - 4.700000000000000e+001 KeyOrganics
melting_point 45 - 47 KeyOrganics
Warnings IRRITANT Matrix Scientific

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