UCSF

ZINC02002350

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 15 Yes

Popular Name: 4-(2-Chlorophenoxy)aniline 4-(2-Chlorophenoxy)aniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 56705-85-2 , 81574-47-2

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) 3.40 -0.33 -5.71 2 2 0 35 219.671 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 214 - 216 Enamine Building Blocks
MP 214...216 Enamine Building Blocks
Melting_Point 81-83? Alfa-Aesar
Melting_Point 81-83° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0387106A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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