UCSF

ZINC01996016

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 12 Yes

Popular Name: 4'-CHLORO-2-METHYLPROPIOPHENONE 4'-CHLORO-2-METHYLPROPIOPHENONE

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CAS Numbers: 18713-58-1 , [18713-58-1]

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) 3.26 1.95 -5.17 0 1 0 17 182.65 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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