UCSF

ZINC55157329

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 10 Yes

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Vendors

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) 0.57 2.03 -4.55 2 3 0 52 145.202 3

Vendor Notes

Note Type Comments Provided By
MP 139 - 141 Enamine Building Blocks
MP 139...141 Enamine Building Blocks
MP 156-162o C Indofine
MP 168-175 °C (dec.) Indofine
Melting_Point 168-175? Alfa-Aesar
Melting_Point 168-175° Alfa-Aesar
MP 170-175 °C Indofine
Mp [°C] 206 - 216 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Purity 99% min APIChem
PUBCHEM_PATENT_ID EP0708781A1; US5773423; WO1995002604A1 IBM Patent Data
Notes USP, pyrogen free Apollo Scientific Bioactives

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