UCSF

ZINC01081165

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Substance Information

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

Popular Name: 9,9-Dimethyl-9H-xanthene 9,9-Dimethyl-9H-xanthene

Find On: PubMed — Wikipedia — Google

CAS Numbers: 19814-75-6 , [19814-75-6]

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) 4.22 2.42 -6.31 0 1 0 9 210.276 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 114-115?/0.6mm Alfa-Aesar
Boiling_Point 114-115°/0.6mm Alfa-Aesar
MP 35 - 38 Enamine Building Blocks
MP 35...38 Enamine Building Blocks
Melting_Point 40-43? Alfa-Aesar
Melting_Point 40-43° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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