UCSF

ZINC02560131

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 12 Yes

Popular Name: 3-(Difluoromethoxy)benzylamine 3-(Difluoromethoxy)benzylamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1106917-71-8 , 244022-71-7 , [244022-71-7]

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) 1.71 2.11 -48.43 3 2 1 37 174.17 3 ↓
Hi High (pH 8-9.5) 0.76 2.76 -56.55 8 9 1 155 432.508 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 151 - 153 Enamine Building Blocks
MP 151...153 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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