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Maribavir Impurity 30

CAT: 1299-RM-M383030-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M383030-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2033-29-6
Synonyms
5,6-dichloro-1,3-dihydro-2H-benzo[d]imidazol-2-one
Molecular Formula
C7H4Cl2N2O
Molecular Weight
203.02
Target Alternative Name
Maribavir

Chemical Information

5,6-Dichloro-1,3-Dihydro-2H-Benzimidazol-2-One
CAS Number2033-29-6
PubChem CID9899148
IUPAC Name5,6-dichloro-1,3-dihydrobenzimidazol-2-one
Molecular FormulaC7H4Cl2N2O
Molecular Weight203.02
XLogP1.8
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity192
SMILES
C1=C2C(=CC(=C1Cl)Cl)NC(=O)N2
InChI
InChI=1S/C7H4Cl2N2O/c8-3-1-5-6(2-4(3)9)11-7(12)10-5/h1-2H,(H2,10,11,12)
InChIKey
HQBYAESCKCDTDJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,6-Dichloro-1,3-Dihydro-2H-Benzimidazol-2-One
CAS: 2033-29-6
CID: 9899148
Formula: C7H4Cl2N2O
MW: 203.02
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight203.02
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass201.9700681
Monoisotopic Mass201.9700681
Topological Polar Surface Area41.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity192
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes