UCSF

ZINC02018427

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 10 Yes

Popular Name: 3-methoxy-4-methylaniline 3-methoxy-4-methylaniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16452-01-0 , [16452-01-0]

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) 1.45 2.42 -4.32 2 2 0 35 137.182 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 56-60? Alfa-Aesar
Melting_Point 56-60° Alfa-Aesar
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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