UCSF

ZINC00402745

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 Yes

Popular Name: 6-Benzyloxyindole 6-Benzyloxyindole

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CAS Numbers: 1215-59-4 , 15903-94-3 , 914348-98-4 , [15903-94-3]

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) 3.79 0.36 -7 1 2 0 25 223.275 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 114-116? Alfa-Aesar
MP 114-116° Matrix Scientific
MP 117 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific

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