Amiodarone EP Impurity F

CAT: 1299-RM-A041806-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-A041806-01Size:10 mg

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CAS Number

147030-50-0

Synonyms

(2-butylbenzofuran-3-yl) (4-hydroxy-3-iodophenyl) methanone

Molecular Formula

C19H17IO3

Molecular Weight

420.24

Target Alternative Name

Amiodarone

Product Name Synonym

(2-butylbenzofuran-3-yl) (4-hydroxy-3-iodophenyl) methanone

Chemical Information

(2-Butylbenzofuran-3-yl)(4-hydroxy-3-iodophenyl)methanone

CAS Number	147030-50-0
PubChem CID	13455774
IUPAC Name	(2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3-iodophenyl)methanone
Molecular Formula	C19H17IO3
Molecular Weight	420.2
XLogP	5.8
Topological Polar Surface Area	50.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	23
Formal Charge	0
Complexity	413

SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)O)I

InChI

InChI=1S/C19H17IO3/c1-2-3-7-17-18(13-6-4-5-8-16(13)23-17)19(22)12-9-10-15(21)14(20)11-12/h4-6,8-11,21H,2-3,7H2,1H3

InChIKey

SPJWRQCARFHMEB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 147030-50-0

CID: 13455774

Formula: C19H17IO3

MW: 420.2

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	420.2
XLogP3	5.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	420.02224
Monoisotopic Mass	420.02224
Topological Polar Surface Area	50.4 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	413
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-A041801-01	Amiodarone EP Impurity A
RM-A041807-01	Amiodarone EP Impurity G
RM-A041804-01	Amiodarone EP Impurity D
RM-A041802-01	Amiodarone EP Impurity B
RM-A041805-01	Amiodarone EP Impurity E
RM-A041803-01	Amiodarone EP Impurity C
RM-A041808-01	Amiodarone EP Impurity H ((controlled substance)
RM-T162006-01	Tryptophan EP Impurity F; N-Acetyltryptophan EP Impurity F
RM-A262006-01	Azathioprine EP Impurity F; Didanosine EP Impurity A
RM-D080802-01	Diphenhydramine EP Impurity A; Dimenhydrinate EP Impurity F

Catalog	Name
IA63609-01	Amiodarone impurity E
AR-A06259-01	Amiodarone Impurity 10
AR-A06265-01	Amiodarone Impurity 18
AR-A06263-01	Amiodarone Impurity 14
AR-A06264-01	Amiodarone Impurity 15
AR-A06261-01	Amiodarone Impurity 12
AR-A06260-01	Amiodarone Impurity 11
AR-A06258-01	Amiodarone Impurity 9
AR-A04870-01	Amiodarone Diketone Impurity
AR-A01953-01	Amiodarone Impurity 2