UCSF

ZINC01758363

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 16 Yes

Popular Name: Z-BETA-ALA-OH Z-BETA-ALA-OH

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2304-94-1 , [2304-94-1]

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) 1.06 3.63 -47.32 1 5 -1 78 222.22 6 ↓

Vendor Notes

Note Type Comments Provided By
MP 100-105°C Indofine
MP 104 - 108 Enamine Building Blocks
MP 105 TCI
MP 105 - 107 Enamine Building Blocks
Melting_Point 105-107? Alfa-Aesar
Melting_Point 105-107° Alfa-Aesar
MP 105...107 Enamine Building Blocks
Mp [°C] 105.3 - 107.2 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. Acros Organics

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