UCSF

ZINC02037377

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 13 Yes

Popular Name: 4-(3-methylbutoxy)aniline 4-(3-methylbutoxy)aniline

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CAS Numbers: 10141-51-2 , 5198-05-0 , [5198-05-0]

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) 2.72 4.69 -3.61 2 2 0 35 179.263 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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