UCSF

ZINC19616412

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2008 14 Yes

Popular Name: N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamine N,N-Diethyl-1,1,2,3,3,3-hexafluo…

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CAS Number: 309-88-6

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) 2.93 3.5 -3.87 0 1 0 3 223.16 5 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 56-57?/58mm Alfa-Aesar
Boiling_Point 56-57°/58mm Alfa-Aesar
Purity 95% Fluorochem
Purity 97% Fluorochem
_Notes Active fluorinating agent see: Ishikawa, Bull. Chem.Soc. Jpn., 1979, 52, 3377 Apollo Scientific
Hazard C: Corrosive Acros Organics
H phrase H318: Causes serious eye damage Acros Organics
H phrase H318: Causes serious eye damage; H314: Causes severe skin burns and eye damage; H226: Flammable liquid and vapor Acros Organics
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 R10: Flammable. Acros Organics
R phrase R10: Flammable.; R34: Causes burns. Acros Organics
S phrase S13: Keep away from food, drink and animal feedingstuffs. Acros Organics
S phrase S13: Keep away from food, drink and animal feedingstuffs.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of a Acros Organics

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