UCSF

ZINC00404432

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 16 Yes

Popular Name: 2-(1,3-Benzoxazol-2-yl)phenol 2-(1,3-Benzoxazol-2-yl)phenol

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CAS Numbers: 23467-27-8 , 835-64-3 , [835-64-3]

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 3.38 2.95 -10.53 1 3 0 46 211.22 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 110 TCI
MP 122-124° Matrix Scientific
MP 124 TCI
BP 338 TCI
BP 338° Matrix Scientific
Warnings IRRITANT Matrix Scientific

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