UCSF

ZINC02382064

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 10 Yes

Popular Name: 2-Chloro-5-fluorobenzyl alcohol 2-Chloro-5-fluorobenzyl alcohol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 261762-59-8 , [261762-59-8]

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) 2.05 -0.59 -3.87 1 1 0 20 160.575 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 68-72? Alfa-Aesar
Melting_Point 68-72° Alfa-Aesar
Purity 97% Matrix Scientific
PUBCHEM_PATENT_ID EP0212428A1; US4731364 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.