Atenolol EP Impurity D

CAT: 1299-RM-A201404-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-A201404-01Size:10 mg

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CAS Number

115538-83-5

Synonyms

2-[4-[ (2RS) -3-chloro-2-hydroxypropoxy]phenyl]acetamide

Molecular Formula

C11H14ClNO3

Molecular Weight

243.69

Target Alternative Name

Atenolol

Product Name Synonym

2-[4-[ (2RS) -3-chloro-2-hydroxypropoxy]phenyl]acetamide

Chemical Information

2-(4-(3-Chloro-2-hydroxypropoxy)phenyl)acetamide, (+-)-

CAS Number	115538-83-5
PubChem CID	572460
IUPAC Name	2-[4-(3-chloro-2-hydroxypropoxy)phenyl]acetamide
Molecular Formula	C11H14ClNO3
Molecular Weight	243.68
XLogP	0.4
Topological Polar Surface Area	72.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	16
Formal Charge	0
Complexity	217

SMILES

C1=CC(=CC=C1CC(=O)N)OCC(CCl)O

InChI

InChI=1S/C11H14ClNO3/c12-6-9(14)7-16-10-3-1-8(2-4-10)5-11(13)15/h1-4,9,14H,5-7H2,(H2,13,15)

InChIKey

OQFMSHFNOSFLJU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 115538-83-5

CID: 572460

Formula: C11H14ClNO3

MW: 243.68

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	243.68
XLogP3	0.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	243.0662210
Monoisotopic Mass	243.0662210
Topological Polar Surface Area	72.6 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	217
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-A201401-01	Atenolol EP Impurity A
RM-A201402-01	Atenolol EP Impurity B
RM-A201406-01	Atenolol EP Impurity F
RM-A201408-01	Atenolol EP Impurity H
RM-A201403-01	Atenolol EP Impurity C
RM-A201407-01	Atenolol EP Impurity G
RM-A201412-01	Atenolol EP Impurity I
RM-A201405-01	Atenolol EP Impurity E
RM-I161504-01	Isotretinoin EP Impurity D; Tretinoin EP Impurity D
RM-L202404-01	Levothyroxine EP Impurity D; Liothyronine EP Impurity D