UCSF

ZINC01673669

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 Yes

Popular Name: 2-Bromo-4-methoxyphenol 2-Bromo-4-methoxyphenol

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CAS Numbers: 17332-11-5 , 17332-12-6 , N/A , [17332-11-5]

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) 2.51 -1.45 -4.3 1 2 0 29 203.035 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 115 TCI
MP 43 TCI
MP 43 - 45 Enamine Building Blocks
MP 43...45 Enamine Building Blocks
MP 47° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific
melting_point LMS KeyOrganics

Activity (Go SEA)

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