UCSF

ZINC00035770

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 11 No

Popular Name: 2-(Bromomethyl)benzoic acid 2-(Bromomethyl)benzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 7115-89-1 , 786593-22-4 , [7115-89-1]

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) 2.17 0.11 -48.73 0 2 -1 40 214.038 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point ca 145? dec. Alfa-Aesar
Melting_Point ca 145° dec. Alfa-Aesar

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