4-Iodopropofol

4-Iodopropofol
Identifiers
	IUPAC name 2,6-diisopropyl-4-iodophenol;
CAS Number	169255-48-5 ;
PubChem CID	9882905;
ChemSpider	8058580 ;
UNII	6WD5JT8TB8;
ChEMBL	ChEMBL53267 ;
CompTox Dashboard (EPA)	DTXSID10432353 ;
ECHA InfoCard	100.220.512
Chemical and physical data
Formula	C12H17IO
Molar mass	304.171 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES Oc1c(C(C)C)cc(I)cc1C(C)C;
	InChI InChI=1S/C12H17IO/c1-7(2)10-5-9(13)6-11(8(3)4)12(10)14/h5-8,14H,1-4H3 ; Key:JMJHJCFWTNRPEI-UHFFFAOYSA-N ;
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4-Iodopropofol is a drug derived from the commonly used sedative anaesthetic agent, propofol. 4-Iodopropofol has similar effects to propofol on isolated receptors, acting primarily as a GABA_A positive modulator and sodium channel blocker,^[1]^[2]^[3]^[4] but when given to animals it has only anxiolytic and anticonvulsant effects, lacking the strong sedative-hypnotic profile of propofol.^[5]

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Identifiers

IUPAC name 2,6-diisopropyl-4-iodophenol
CAS Number	169255-48-5^N
PubChem CID	9882905
ChemSpider	8058580^Y
UNII	6WD5JT8TB8
ChEMBL	ChEMBL53267^Y
CompTox Dashboard (EPA)	DTXSID10432353
ECHA InfoCard	100.220.512
Chemical and physical data
Formula	C₁₂H₁₇IO
Molar mass	304.171 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES Oc1c(C(C)C)cc(I)cc1C(C)C
InChI InChI=1S/C12H17IO/c1-7(2)10-5-9(13)6-11(8(3)4)12(10)14/h5-8,14H,1-4H3^Y Key:JMJHJCFWTNRPEI-UHFFFAOYSA-N^Y
^NY (what is this?) (verify)