UCSF

ZINC00397922

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2005 8 Yes

Popular Name: 3-methoxybutanoic acid 3-methoxybutanoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 10024-70-1 , [10024-70-1]

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) 0.18 2.24 -47.33 0 3 -1 49 117.124 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP1062361A2; WO1999046402A2 IBM Patent Data

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