UCSF

ZINC00157614

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: 2,5-Diethoxyaniline 2,5-Diethoxyaniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 94-85-9 , [94-85-9]

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) 2.21 -0.67 -4.53 2 3 0 44 181.235 4 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 190-192?/30mm Alfa-Aesar
Boiling_Point 190-192°/30mm Alfa-Aesar
Melting_Point 84-86? Alfa-Aesar
Melting_Point 84-86° Alfa-Aesar
MP 85 TCI
MP 85 - 87 Enamine Building Blocks
MP 85...87 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% APIChem

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