UCSF

ZINC05466353

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 19 Yes

Popular Name: 3,4-dibutoxybenzoic acid 3,4-dibutoxybenzoic acid

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CAS Number: 206536-14-3

Other Names:

MFCD01462074

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) 4.37 1.56 -48.77 0 4 -1 58 265.329 9 ↓

Vendor Notes

Note Type Comments Provided By
MP 140 - 142 Enamine Building Blocks
MP 140...142 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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