UCSF

ZINC02382213

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Substance Information

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

Popular Name: 3-Fluoro-4-methylbenzyl alcohol 3-Fluoro-4-methylbenzyl alcohol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 192702-79-7 , [192702-79-7]

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) 1.82 2.53 -5.26 1 1 0 20 140.157 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 33-36? Alfa-Aesar
Melting_Point 33-36° Alfa-Aesar
MP 34 - 36 Enamine Building Blocks
MP 34...36 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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