UCSF

ZINC06661958

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2006 12 Yes

Popular Name: 3-amino-3-cyclohexylpropanoic acid 3-amino-3-cyclohexylpropanoic acid

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CAS Numbers: 129042-71-3 , 37107-50-9 , 91383-14-1 , [129042-71-3]

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) 0.98 3.2 -43.75 3 3 0 68 171.24 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 221 KeyOrganics
MP 221-223° Matrix Scientific
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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