UCSF

ZINC00161035

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Popular Name: 2-Chloro-N-(4-isopropylphenyl)acetamide 2-Chloro-N-(4-isopropylphenyl)ac…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1527-61-3 , [1527-61-3]

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) 3.23 0.59 -9.73 1 2 0 29 211.692 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 138 - 140 KeyOrganics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID US5639713; US5831126 IBM Patent Data

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