Ciprofibrate impurity A

CAT: 0926-ZIC05889-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-ZIC05889-02Size:25 mg

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CAS Number

1474058-89-3

Smiles

CC (C) (C (=O) O) OC1=CC=C (C=C1) C=C

Molecular Formula

C12H14O3

Molecular Weight

206.24 g/mol

Controlled

Chemical Information

Ciprofibrate impurity A

CAS Number	1474058-89-3
PubChem CID	20143872
IUPAC Name	2-(4-ethenylphenoxy)-2-methylpropanoic acid
Molecular Formula	C12H14O3
Molecular Weight	206.24
XLogP	2.7
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	15
Formal Charge	0
Complexity	237

SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)C=C

InChI

InChI=1S/C12H14O3/c1-4-9-5-7-10(8-6-9)15-12(2,3)11(13)14/h4-8H,1H2,2-3H3,(H,13,14)

InChIKey

IIJBUUJYXSWCGW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1474058-89-3

CID: 20143872

Formula: C12H14O3

MW: 206.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	206.24
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	206.094294304
Monoisotopic Mass	206.094294304
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	237
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
VHD01505-01	Ciprofibrate-d6
FFA23251-01	Ciprofibrate methyl ester
CEA62315-01	Ciprofibrate-o-β-glucuronide
BD164311	Ciprofibrate - Bio-X TM
KLB13369-01	Impurity of calcipotriol
IT182479-01	Tofacitinib impurity
IP182103	Pravastatin impurity A
IN167105-01	Naltrexone impurity A
ID157391-01	Desoximetasone impurity A
IC63739-01	Cisplatin impurity A