Gemfibrozil EP Impurity E

CAT: 1299-RM-G051305-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-G051305-04Size:100 mg

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CAS Number

500904-61-0

Synonyms

5- (2,5-dimethyl-4- (prop-1-en-1-yl) phenoxy) -2,2-dimethylpentanoic acid

Molecular Formula

C18H26O3

Molecular Weight

290.4

Target Alternative Name

Gemfibrozil

Product Name Synonym

5- (2,5-dimethyl-4- (prop-1-en-1-yl) phenoxy) -2,2-dimethylpentanoic acid

Chemical Information

5-(2,5-Dimethyl-4-(prop-1-en-1-yl)phenoxy)-2,2-dimethylpentanoic acid

CAS Number	500904-61-0
PubChem CID	59043336
IUPAC Name	5-(2,5-dimethyl-4-prop-1-enylphenoxy)-2,2-dimethylpentanoic acid
Molecular Formula	C18H26O3
Molecular Weight	290.4
XLogP	4.8
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Heavy Atom Count	21
Formal Charge	0
Complexity	359

SMILES

CC=CC1=C(C=C(C(=C1)C)OCCCC(C)(C)C(=O)O)C

InChI

InChI=1S/C18H26O3/c1-6-8-15-11-14(3)16(12-13(15)2)21-10-7-9-18(4,5)17(19)20/h6,8,11-12H,7,9-10H2,1-5H3,(H,19,20)

InChIKey

ZWBXHPOXWIJOJR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 500904-61-0

CID: 59043336

Formula: C18H26O3

MW: 290.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	290.4
XLogP3	4.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	290.18819469
Monoisotopic Mass	290.18819469
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	359
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-G051308-01	Gemfibrozil EP Impurity H
RM-G051309-01	Gemfibrozil EP Impurity I
RM-G051302-01	Gemfibrozil EP Impurity B
RM-G051307-01	Gemfibrozil EP Impurity G
RM-G051303-01	Gemfibrozil EP Impurity C
RM-G051304-01	Gemfibrozil EP Impurity D
RM-G051306-01	Gemfibrozil EP Impurity F
RM-G051301-01	Gemfibrozil EP Impurity A; Metacresol 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

Catalog	Name
278313-01	Iso-Gemfibrozil (gemfibrozil impurity)
AR-G01234-01	Gemfibrozil EP Impurity A
AR-G01671-01	Gemfibrozil EP Impurity D
AR-G02181-01	Gemfibrozil EP Impurity F
AR-G01672-01	Gemfibrozil EP Impurity E
AR-G01673-01	Gemfibrozil EP Impurity H
AR-G01233-01	Gemfibrozil EP Impurity I
FD23652-01	Gemfibrozil