UCSF

ZINC01849645

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 10 Yes

Popular Name: Ethyl 2-methylpentanoate Ethyl 2-methylpentanoate

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CAS Numbers: 39255-32-8 , [39255-32-8]

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) 2.73 2.84 -4.42 0 2 0 26 144.214 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 153 TCI
Boiling_Point 153? Alfa-Aesar
Boiling_Point 153° Alfa-Aesar

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