UCSF

ZINC08579890

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2007 11 Yes

Popular Name: 4-Hydroxyquinoline 4-Hydroxyquinoline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 24206-39-1 , 529-37-3 , 611-36-9 , 752201-35-7 , 758684-45-6 , N/A , [611-36-9]

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 0.65 4.33 -15.71 1 2 0 33 145.161 0 ↓
Lo Low (pH 4.5-6) 1.95 2.39 -30.88 2 2 1 34 146.169 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 149-152 °C(lit.) Indofine
Melting_Point 201-205? Alfa-Aesar
Melting_Point 201-205° Alfa-Aesar
MP 202 - 204 Enamine Building Blocks
Mp [°C] 202 - 206 Acros Organics
MP 202...204 Enamine Building Blocks
MP 203 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% APIChem
PUBCHEM_PATENT_ID EP0471516A1; EP0488602A1; EP0498721A1; EP0498721B1; EP0511879A1; EP0511879B1; EP0513387A1; EP0532239A1; EP0532239B1; EP0600092A1; EP0608565A1; EP0751944A1; EP0751944B1; EP0816357A1; EP0934937A1; EP1028946A1; EP1040100A1; EP1040829A3; US4220470; US5225438 IBM Patent Data
PUBCHEM_PATENT_ID EP0513387A1; EP0751944A1; EP0751944B1; EP0934937A1; US5643932; US5677319; US5955481; US6080764; WO1995026347A1; WO1996011196A1; WO1996026207A1; WO1999065881A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0690847A1; US5563141; US5750754; US5753659; WO1994022835A2 IBM Patent Data
PUBCHEM_PATENT_ID EP0751944A1; EP0751944B1; EP0773248A1; US5668245; US5955481; WO1995026347A1; WO1996011196A1; WO1996026207A1; WO1999065881A1; WO2000064876A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0751944A1; EP0751944B1; US5955481; WO1995026347A1; WO1996011196A1; WO1996026207A1; WO1999065881A1 IBM Patent Data
H phrase H315: Causes skin irritation Acros Organics
H phrase H315: Causes skin irritation; H319: Causes serious eye irritation; H312: Harmful in contact with skin; H332: Harmful if inhaled; H302: Harmful if swallowed; H335: May cause respiratory irritation Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/p Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; 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. 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 XN: Harmful Acros Organics

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