UCSF

ZINC19089978

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2008 11 Yes

Popular Name: 2-(4-methylphenyl)propan-2-amine 2-(4-methylphenyl)propan-2-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6526-79-0 , [6526-79-0]

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) 2.58 4.37 -40.25 3 1 1 28 150.245 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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