UCSF

ZINC01259344

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 14th, 2004 17 Yes

Popular Name: 4'-Methylbiphenyl-2-carboxylic acid methyl ester 4'-Methylbiphenyl-2-carboxylic a…

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CAS Numbers: 114772-34-8 , [114772-34-8]

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) 3.96 3.08 -7.23 0 2 0 26 226.275 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 59 TCI
MP 60-61° Oakwood Chemical
Purity 95% Fluorochem
Purity 98% Fluorochem

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