Moxifloxacin Impurity ⅳ

CAT: 1299-RM-M160246-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-M160246-01Size:10 mg

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CAS Number

112811-65-1

Synonyms

2,4,5-trifluoro-3-methoxybenzoic acid

Molecular Formula

C8H5F3O3

Molecular Weight

206.12

Target Alternative Name

Moxifloxacin

Product Name Synonym

2,4,5-trifluoro-3-methoxybenzoic acid

Chemical Information

2,4,5-Trifluoro-3-methoxybenzoic acid

CAS Number	112811-65-1
PubChem CID	2733970
IUPAC Name	2,4,5-trifluoro-3-methoxybenzoic acid
Molecular Formula	C8H5F3O3
Molecular Weight	206.12
XLogP	1.7
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	224

SMILES

COC1=C(C(=CC(=C1F)F)C(=O)O)F

InChI

InChI=1S/C8H5F3O3/c1-14-7-5(10)3(8(12)13)2-4(9)6(7)11/h2H,1H3,(H,12,13)

InChIKey

YVJHZWWMKFQKDC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 112811-65-1

CID: 2733970

Formula: C8H5F3O3

MW: 206.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	206.12
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	206.01907850
Monoisotopic Mass	206.01907850
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	224
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
RM-M160206-01	Moxifloxacin EP Impurity F (N-Methyl Moxifloxacin)
RM-M160201-01	Moxifloxacin EP Impurity A; USP Moxifloxacin Related Compound A
RM-M160231-01	Moxifloxacin Boron Complex Impurity
RM-M160238-01	Moxifloxacin EP Impurity H
RM-M160213-01	Moxifloxacin EP Impurity M
RM-M160426-01	Moxifloxacin Nitroso Impurity 226
RM-M160429-01	Moxifloxacin Nitroso Impurity 229
RM-M160205-01	Moxifloxacin EP Impurity E; USP Moxifloxacin Related Compound E
RM-M160207-01	Moxifloxacin EP Impurity G; USP Moxifloxacin Related Compound G
RM-M160203-01	Moxifloxacin EP Impurity C; USP Moxifloxacin Related Compound C