UCSF

ZINC19504011

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 15 Yes

Popular Name: 3-(2-methoxy-2-oxoethoxy)benzoic acid 3-(2-methoxy-2-oxoethoxy)benzoic…

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CAS Number: 113496-13-2

Other Names:

MFCD09943982

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) 1.74 5.04 -59.23 0 5 -1 76 209.177 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 113 - 115 Enamine Building Blocks
MP 113...115 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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