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Revefenacin Impurity 54

CAT: 1299-RM-R052254-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-R052254-01Size:10 mg
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CAS Number
107201-33-2
Synonyms
Benzyl methyl (2-oxoethyl) carbamate
Molecular Formula
C11H13NO3
Molecular Weight
207.23
Target Alternative Name
Revefenacin
Product Name Synonym
Benzyl methyl (2-oxoethyl) carbamate

Chemical Information

Benzyl N-methyl-N-(2-oxoethyl)carbamate
CAS Number107201-33-2
PubChem CID12010768
IUPAC Namebenzyl N-methyl-N-(2-oxoethyl)carbamate
Molecular FormulaC11H13NO3
Molecular Weight207.23
XLogP1.7
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity212
SMILES
CN(CC=O)C(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C11H13NO3/c1-12(7-8-13)11(14)15-9-10-5-3-2-4-6-10/h2-6,8H,7,9H2,1H3
InChIKey
ULSOLOBYKJRHGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyl N-methyl-N-(2-oxoethyl)carbamate
CAS: 107201-33-2
CID: 12010768
Formula: C11H13NO3
MW: 207.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight207.23
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass207.08954328
Monoisotopic Mass207.08954328
Topological Polar Surface Area46.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity212
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

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