UCSF

ZINC01845652

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 11 Yes

Popular Name: 2-PHENYLTHIOPHENE 2-PHENYLTHIOPHENE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 825-55-8 , [825-55-8]

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) 3.52 0.94 -3.62 0 0 0 0 160.241 1 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 256 Acros Organics
Boiling_Point 256? Alfa-Aesar
Mp [°C] 34 - 36 Acros Organics
Melting_Point 34-36? Alfa-Aesar
MP 36 TCI
H phrase H312: Harmful in contact with skin Acros Organics
H phrase H312: Harmful in contact with skin; H302: Harmful if swallowed; H332: Harmful if inhaled Acros Organics
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; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P304 + P340: IF INHALED: R Acros Organics
R phrase R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. Acros Organics
S phrase S36/37: Wear suitable protective clothing and gloves. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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