UCSF

ZINC00163859

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 No

Popular Name: Ethyl 2-benzylacetoacetate Ethyl 2-benzylacetoacetate

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CAS Number: 620-79-1

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) 2.27 3.1 -7.18 0 3 0 43 220.268 6 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 275-276? Alfa-Aesar
Boiling_Point 275-276° Alfa-Aesar
BP 284 TCI

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