UCSF

ZINC04705523

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 12 Yes

Popular Name: 4-Methyl-2-phenylimidazole 4-Methyl-2-phenylimidazole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 827-43-0 , [827-43-0]

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) 2.26 6.02 -26.97 2 2 1 30 159.212 1 ↓
Ref Reference (pH 7) 2.26 6.03 -27.03 2 2 1 30 159.212 1 ↓
Mid Mid (pH 6-8) 2.26 5.61 -8.04 1 2 0 29 158.204 1 ↓
Mid Mid (pH 6-8) 2.26 5.58 -7.53 1 2 0 29 158.204 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 174-176? Alfa-Aesar
Melting_Point 174-176° Alfa-Aesar
MP 181 TCI
PUBCHEM_PATENT_ID EP1042299A1; US6020357; WO1998028269A1; WO1998028282A2; WO1999032454A1; WO1999050255A2 IBM Patent Data

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