UCSF

ZINC01559804

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 10 No

Popular Name: 3-Methoxybenzyl chloride 3-Methoxybenzyl chloride

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CAS Numbers: 824-98-6 , [824-98-6]

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) 2.55 1.27 -4.22 0 1 0 9 156.612 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 122-123?/12mm Alfa-Aesar
Boiling_Point 122-123°/12mm Alfa-Aesar
BP [°C] 124 (p=13 torr) Acros Organics
BP 124°/13mm Matrix Scientific
BP 125 / 22 TCI
Purity 98% Fluorochem
Hazard C: Corrosive Acros Organics
Warnings Corrosive/Stored under Argon/Moisture Sensitive/Refrigerate Matrix Scientific
H phrase H314: Causes severe skin burns and eye damage Acros Organics
H phrase H318: Causes serious eye damage Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting Acros Organics
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r Acros Organics
R phrase R34: Causes burns. Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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