UCSF

ZINC03886702

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 16 Yes

Popular Name: 5-Chloro-2-(3-methylphenoxy)aniline 5-Chloro-2-(3-methylphenoxy)aniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 56966-51-9 , [56966-51-9]

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) 4.21 6.49 -3.69 2 2 0 35 233.698 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 93 - 97 Enamine Building Blocks
MP 94 - 96 Enamine Building Blocks
MP 94...96 Enamine Building Blocks
purity 95 Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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