UCSF

ZINC03860454

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 28 No

Popular Name: Fluorescein isothiocyanate isomer I Fluorescein isothiocyanate isomer I

Find On: PubMed — Wikipedia — Google

CAS Numbers: 27072-45-3 , 3326-32-7 , 63469-13-6 , [27072-45-3] , [3326-32-7]

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) 5.03 -2.38 -11.87 2 6 0 88 389.388 1 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] >360 Acros Organics
Melting_Point >360? Alfa-Aesar
Melting_Point >360° Alfa-Aesar
Patent Database Links EP1607384; EP1642588; US2002176895; US2003229201; US2004214199; US2005080273; US2005096381; US2006057068; US2006058508; US2006167224; US2007179288; US2007224634; US2008293705; WO2005051905; WO2005067644; WO2005101020 ChEBI
H phrase H317: May cause an allergic skin reaction Acros Organics
H phrase H317: May cause an allergic skin reaction; H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled; H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin irritation; H302: Harmful if swallow Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P304 + P341: IF INHALED: If breathing is difficult, remove to fresh air and keep at rest in a position comfortable for breathing; P342 + P311: If experiencing respiratory symptoms: Call a POISON CENTE Acros Organics
R phrase R22: Harmful if swallowed. Acros Organics
R phrase R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R42/43: May cause sensitisation by inhalation and skin contact. Acros Organics
S phrase S22: Do not breathe dust. Acros Organics
S phrase S22: Do not breathe dust.; 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 accident or if you feel unwell, s Acros Organics
Hazard XN: Harmful Acros Organics

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