UCSF

ZINC08729968

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 15 Yes

Popular Name: methyl 2-ethyl-1,3-benzoxazole-5-carboxylate methyl 2-ethyl-1,3-benzoxazole-5…

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CAS Numbers: 914862-20-4 , 924862-20-4 , [924862-20-4]

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) 2.67 0.4 -9.47 0 4 0 52 205.213 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 44 - 45 KeyOrganics
MP 44-45° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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