UCSF

ZINC00397622

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 Yes

Popular Name: 4-Benzyloxybromobenzene 4-Benzyloxybromobenzene

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6793-92-6 , [6793-92-6]

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) 4.40 0.63 -3.71 0 1 0 9 263.134 3 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 166 - 167 (p=4 torr) Acros Organics
Boiling_Point 166-167?/3mm Alfa-Aesar
Boiling_Point 166-167°/3mm Alfa-Aesar
Melting_Point 61-63? Alfa-Aesar
MP 61-63° Matrix Scientific
MP 62 TCI
Mp [°C] 62 - 64 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Matrix Scientific
H phrase H315: Causes skin irritation Acros Organics
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with wate Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
Hazard XI: Irritant Acros Organics

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