UCSF

ZINC00393808

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 Yes

Popular Name: p-Tolyl Phenylacetate p-Tolyl Phenylacetate

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CAS Numbers: 101-94-0 , [101-94-0]

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) 3.53 3.4 -7.93 0 2 0 26 226.275 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 148 / 1.5 TCI
MP 75 TCI

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