UCSF

ZINC02530711

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 Yes

Popular Name: 3-(3-Aminophenyl)propionic acid 3-(3-Aminophenyl)propionic acid

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CAS Numbers: 102879-44-7 , 1664-54-6 , 68969-82-4 , [1664-54-6]

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) 0.93 3.6 -47.16 2 3 -1 66 164.184 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 98% Matrix Scientific
Melting_Point 99-101? Alfa-Aesar
Melting_Point 99-101° Alfa-Aesar
Warnings Irritant Matrix Scientific

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