UCSF

ZINC02464595

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 16 Yes

Popular Name: N-Benzyl-4-methoxyaniline N-Benzyl-4-methoxyaniline

Find On: PubMed — Wikipedia — Google

CAS Number: 17377-95-6

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) 3.25 6.38 -4.17 1 2 0 21 213.28 4 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 138-140?/0.1mm Alfa-Aesar
Boiling_Point 138-140°/0.1mm Alfa-Aesar
BP 238 / 32 TCI
MP 48 TCI
MP 48 - 50 Enamine Building Blocks
Melting_Point 48-50? Alfa-Aesar
Melting_Point 48-50° Alfa-Aesar
MP 48...50 Enamine Building Blocks
melting_point 50 - 55 KeyOrganics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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