UCSF

ZINC02168264

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 13 Yes

Popular Name: Boc-beta-Ala-OH Boc-beta-Ala-OH

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3303-84-2 , N/A

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) 0.65 1.68 -46.77 1 5 -1 78 188.203 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 70 - 72 Enamine Building Blocks
MP 70...72 Enamine Building Blocks
Melting_Point 73-76? Alfa-Aesar
Melting_Point 73-76° Alfa-Aesar
MP 74-77o C Indofine
MP 76 - 78 Enamine Building Blocks
MP 76-78 °C Indofine
MP 76-78° Oakwood Chemical
MP 77 TCI
Mp [°C] 77.5 - 78.5 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Purity 98% min APIChem
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% )