UCSF

ZINC01648187

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

Popular Name: 2-(2-Ethoxyethoxy)ethyl acetate 2-(2-Ethoxyethoxy)ethyl acetate

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CAS Number: 112-15-2

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) 0.35 3.6 -8.73 0 4 0 45 176.212 8 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 25 Acros Organics
Melting_Point 25? Alfa-Aesar
Melting_Point 25° Alfa-Aesar
BP [°C] 210 - 220 Acros Organics
BP 218 TCI
Boiling_Point 218-219? Alfa-Aesar
Boiling_Point 218-219° Alfa-Aesar
H phrase H319: Causes serious eye irritation Acros Organics
H phrase H335: May cause respiratory irritation Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
R phrase R19: May form explosive peroxides. Acros Organics
R phrase R36: Irritating to eyes. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
Hazard XI: Irritant Acros Organics

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