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Moxifloxacin Impurity 73

CAT: 1299-RM-M160273-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M160273-01Size:10 mg
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CAS Number
86732-18-5
Synonyms
2-benzyl-5-methyltetrahydropyrrolo[3,4-c]pyrrole-1,3 (2H,3aH) -dione
Molecular Formula
C14H16N2O2
Molecular Weight
244.29
Target Alternative Name
Moxifloxacin
Product Name Synonym
2-benzyl-5-methyltetrahydropyrrolo[3,4-c]pyrrole-1,3 (2H,3aH) -dione

Chemical Information

2-Benzyl-5-methyltetrahydropyrrolo[3,4-c]pyrrole-1,3-dione
CAS Number86732-18-5
PubChem CID12958517
IUPAC Name5-benzyl-2-methyl-1,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,6-dione
Molecular FormulaC14H16N2O2
Molecular Weight244.29
XLogP0.5
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity339
SMILES
CN1CC2C(C1)C(=O)N(C2=O)CC3=CC=CC=C3
InChI
InChI=1S/C14H16N2O2/c1-15-8-11-12(9-15)14(18)16(13(11)17)7-10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChIKey
SLEWLTIVHNDEEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Benzyl-5-methyltetrahydropyrrolo[3,4-c]pyrrole-1,3-dione
CAS: 86732-18-5
CID: 12958517
Formula: C14H16N2O2
MW: 244.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight244.29
XLogP30.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass244.121177757
Monoisotopic Mass244.121177757
Topological Polar Surface Area40.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity339
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes