UCSF

ZINC02243824

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2004 11 Yes

Popular Name: 1-(2,4-Dimethylphenyl)ethanamine 1-(2,4-Dimethylphenyl)ethanamine

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CAS Numbers: 102877-07-6 , 76935-60-9 , 856563-10-5 , 856563-12-7 , [102877-07-6]

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) 0.63 4.39 -42.91 3 1 1 28 150.245 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 224-227° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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