UCSF

ZINC02166831

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 6 No

Popular Name: 2-Chloropropanamide 2-Chloropropanamide

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CAS Numbers: 27816-36-0 , 7474-04-6 , 94-20-2 , 96-30-0

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) 0.01 -0.54 -7.6 2 2 0 43 107.54 1 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 76 - 81 Acros Organics
MP 76...81 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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