UCSF

ZINC01689142

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 Yes

Popular Name: Dimethyl glutarate Dimethyl glutarate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1119-40-0 , [1119-40-0]

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) 0.47 4.5 -11.9 0 4 0 53 160.169 6 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 37 Acros Organics
Melting_Point 37? Alfa-Aesar
Melting_Point 37° Alfa-Aesar
BP [°C] 210 - 215 Acros Organics
Boiling_Point 213-215? Alfa-Aesar
Boiling_Point 213-215° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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

No pre-computed analogs available. Try a structural similarity search.