UCSF

ZINC01668583

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 No

Popular Name: 3-chloro-1-(4-methylphenyl)propan-1-one 3-chloro-1-(4-methylphenyl)propa…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 22422-21-5 , [22422-21-5]

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) 2.79 1.72 -5.3 0 1 0 17 182.65 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 80 - 82 Enamine Building Blocks
MP 80...82 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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