Hexachlorophene (CAS 70-30-4)

건강 상태 :

Solid

용해도 :

Soluble in acetone, ethanol, ether, and chloroform. Insoluble in water.

저장 :

Store at -20° C

녹는점 :

163-165° C (lit.)

비등점 :

470.93° C at 760 mmHg (Predicted)

밀도 :

1.71 g/cm³ (Predicted)

굴절률 :

n²⁰_D 1.67 (Predicted)

IC50 :

Acetylcholinesterase: IC₅₀ = 3.01 µM (human); Androgen Receptor: IC₅₀ = 4.98 µM (rat); MAP kinase p38 alpha: IC₅₀ = 87.6 nM (human); Tyrosine-protein kinase FYN: IC₅₀ = 3.48 µM (human); Neurokinin 2 receptor: IC₅₀ = 4.14 µM (human); Thromboxane-A synthase: IC₅₀ = 3.09 µM (human); MAP kinase ERK2: IC₅₀ = 196 nM (human); ADORA3 protein: IC₅₀ = 638.9 nM (human)

Ki 데이타 :

Adenosine A2a receptor: K_i= 906 nM (human); Serotonin transporter: K_i= 2.31 µM (human); Alpha-2c adrenergic receptor: K_i= 1.01 µM (human)

pK 값 :

pK_a: 6.49 (Predicted)

WGK 독일 :

3

RTECS :

SM0700000

PubChem CID :

Merck 색인 :

14: 4680

MDL 번호 :

MFCD00002171

EC 번호 :

200-733-8

Beilstein 기재 :

2064407

SMILES :

OC1=C(CC2=C(O)C(Cl)=CC(Cl)=C2Cl)C(Cl)=C(Cl)C=C1Cl