Moxifloxacin Impurity 74

CAT: 1596-AR-M05199-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M05199-01Size:10 Units

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CAS Number

2085709-73-3

Molecular Formula

C10H18N2O2

Molecular Weight

198.27

API Name

Moxifloxacin

Chemical Information

Moxifloxacin Impurity 125

CAS Number	2085709-73-3
PubChem CID	102680677
IUPAC Name	ethyl (4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine-6-carboxylate
Molecular Formula	C10H18N2O2
Molecular Weight	198.26
XLogP	0.6
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	220

SMILES

CCOC(=O)N1C[C@@H]2CCCN[C@@H]2C1

InChI

InChI=1S/C10H18N2O2/c1-2-14-10(13)12-6-8-4-3-5-11-9(8)7-12/h8-9,11H,2-7H2,1H3/t8-,9+/m0/s1

InChIKey

LXLHKOWSARZMFX-DTWKUNHWSA-N

Chemical Structure

2D Structure

CAS: 2085709-73-3

CID: 102680677

Formula: C10H18N2O2

MW: 198.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	198.26
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	198.136827821
Monoisotopic Mass	198.136827821
Topological Polar Surface Area	41.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	220
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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-M160266-01	Moxifloxacin Impurity 38; Moxifloxacin Impurity X
RM-M160246-01	Moxifloxacin Impurity ⅳ
RM-M160248-01	Moxifloxacin Impurity ⅵ
RM-M160249-01	Moxifloxacin Impurity ⅶ
RM-M160250-01	Moxifloxacin Impurity ⅷ
RM-M160256-01	Moxifloxacin Impurity ⅺ
RM-M160245-01	Moxifloxacin Impurity ⅲ
RM-M160254-01	Moxifloxacin Impurity ⅹ
RM-M160247-01	Moxifloxacin Impurity ⅴ
RM-M160257-01	Moxifloxacin Impurity ⅻ