Propafenone EP Impurity E

CAT: 1299-RM-P161605-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P161605-01Size:10 mg

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CAS Number

165279-79-8

Synonyms

1- (2- (3-chloro-2-hydroxypropoxy) phenyl) -3-phenylpropan-1-one

Molecular Formula

C18H19ClO3

Molecular Weight

318.79

Target Alternative Name

Propafenone

Product Name Synonym

1- (2- (3-chloro-2-hydroxypropoxy) phenyl) -3-phenylpropan-1-one

Chemical Information

Depropylamino chloro propafenone

CAS Number	165279-79-8
PubChem CID	71315566
IUPAC Name	1-[2-(3-chloro-2-hydroxypropoxy)phenyl]-3-phenylpropan-1-one
Molecular Formula	C18H19ClO3
Molecular Weight	318.8
XLogP	3.4
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	8
Heavy Atom Count	22
Formal Charge	0
Complexity	328

SMILES

C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2OCC(CCl)O

InChI

InChI=1S/C18H19ClO3/c19-12-15(20)13-22-18-9-5-4-8-16(18)17(21)11-10-14-6-2-1-3-7-14/h1-9,15,20H,10-13H2

InChIKey

MSNQYFAIUPNYQK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 165279-79-8

CID: 71315566

Formula: C18H19ClO3

MW: 318.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	318.8
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	8
Exact Mass	318.1022722
Monoisotopic Mass	318.1022722
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	328
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-P161601-01	Propafenone EP Impurity A
RM-P161608-01	Propafenone EP Impurity H
RM-P161606-01	Propafenone EP Impurity F
RM-P161604-01	Propafenone EP Impurity D
RM-P161603-01	Propafenone EP Impurity C
RM-P161602-01	Propafenone EP Impurity B
RM-P161607-01	Propafenone EP Impurity G
RM-L202405-01	Levothyroxine EP Impurity E; Liothyronine EP Impurity E
RM-O132305-01	Omeprazole EP Impurity E; Esomeprazole EP Impurity E
RM-P182605-01	Prazosin EP Impurity E; Doxazosin EP Impurity H; Terazosin EP Impurity E

Catalog	Name
AR-P32777-01	Propafenone Impurity 3
AR-P32780-01	Propafenone Impurity 4
AR-P03034-01	Propafenone impurity 1
AR-P32782-01	Propafenone Impurity 6
AR-P03024-01	Propafenone Impurity A (EP/BP)
AR-P03029-01	Propafenone EP Impurity F
AR-P03031-01	Propafenone EP Impurity H
CS-O-13603	Propafenone EP Impurity D
TRC-P757522-1MG	Propafenone Dimer Impurity-d10
AR-P32781-01	Propafenone Impurity 5 Oxalate