UCSF

ZINC34360942

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 14 Yes

Popular Name: 6-Bromo-2,2-dimethylchroman-4-one 6-Bromo-2,2-dimethylchroman-4-one

Find On: PubMed — Wikipedia — Google

CAS Numbers: 99853-21-1 , [99853-21-1]

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) 3.20 6.08 -5.79 0 2 0 26 255.111 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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