Atorvastatin Impurity 167

CAT: 1299-RM-A202367-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-A202367-04Size:100 mg

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CAS Number

62148-67-8

Synonyms

2-chloro-1- (4-fluorophenyl) -2-phenylethan-1-one

Molecular Formula

C14H10ClFO

Molecular Weight

248.68

Target Alternative Name

Atorvastatin

Product Name Synonym

2-chloro-1- (4-fluorophenyl) -2-phenylethan-1-one

Chemical Information

2-Chloro-1-(4-fluorophenyl)-2-phenylethanone

CAS Number	62148-67-8
PubChem CID	23455668
IUPAC Name	2-chloro-1-(4-fluorophenyl)-2-phenylethanone
Molecular Formula	C14H10ClFO
Molecular Weight	248.68
XLogP	4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	255

SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C14H10ClFO/c15-13(10-4-2-1-3-5-10)14(17)11-6-8-12(16)9-7-11/h1-9,13H

InChIKey

MFOUYNSALQZQNM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 62148-67-8

CID: 23455668

Formula: C14H10ClFO

MW: 248.68

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	248.68
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	248.0404208
Monoisotopic Mass	248.0404208
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	255
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-A202248-01	Atorvastatin Impurity ⅴ
RM-A202247-01	Atorvastatin Impurity ⅳ
RM-A202242-01	Atorvastatin Impurity ⅰ
RM-A202243-01	Atorvastatin Impurity ⅱ
RM-A202244-01	Atorvastatin Impurity ⅲ
RM-A202249-01	Atorvastatin Impurity ⅵ
RM-A202263-01	Atorvastatin Impurity 13 (Atorvastatin Cyclic (Isopropyl) Impurity)
RM-A202270-01	Atorvastatin Impurity 20 (Atorvastatin EP Impurity Q)
RM-R182567-01	Brexpiprazole Impurity 167
RM-C182867-01	Canagliflozin Impurity 167

Catalog	Name
002956	Atorvastatin Epoxydione Impurity
AR-A02846-01	Atorvastatin Impurity 30
AR-A02830-01	Atorvastatin Impurity 16
AR-A02813-01	Atorvastatin Impurity 9
AR-A02858-01	Atorvastatin Impurity 40
AR-A02857-01	Atorvastatin Impurity 38
AR-A07346-01	Atorvastatin Impurity 53
AR-A07343-01	Atorvastatin Impurity 50
AR-A07341-01	Atorvastatin Impurity 47
AR-A07332-01	Atorvastatin Impurity 101