UCSF

ZINC08680041

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2007 12 Yes

Popular Name: 7-Chloroquinolin-4-ol 7-Chloroquinolin-4-ol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 23833-97-8 , 86-99-7 , [86-99-7]

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) 1.31 4.85 -13.06 1 2 0 33 179.606 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 278-282? Alfa-Aesar
Melting_Point 278-282° Alfa-Aesar
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0056765A1; US4412076 IBM Patent Data
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
P phrase P280: Wear protective gloves/protective clothing/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 rinsing Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

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