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Revefenacin Impurity 44

CAT: 1299-RM-R052244-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-R052244-01Size:10 mg
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CAS Number
57561-39-4
Synonyms
Tert-butyl (2-hydroxyethyl) (methyl) carbamate
Molecular Formula
C8H17NO3
Molecular Weight
175.23
Target Alternative Name
Revefenacin
Product Name Synonym
Tert-butyl (2-hydroxyethyl) (methyl) carbamate

Chemical Information

N-(tert-Butoxycarbonyl)-N-methyl-2-aminoethanol
CAS Number57561-39-4
PubChem CID545700
IUPAC Nametert-butyl N-(2-hydroxyethyl)-N-methylcarbamate
Molecular FormulaC8H17NO3
Molecular Weight175.23
XLogP0.4
Topological Polar Surface Area49.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity151
SMILES
CC(C)(C)OC(=O)N(C)CCO
InChI
InChI=1S/C8H17NO3/c1-8(2,3)12-7(11)9(4)5-6-10/h10H,5-6H2,1-4H3
InChIKey
RFDSJHHLGFFVHD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(tert-Butoxycarbonyl)-N-methyl-2-aminoethanol
CAS: 57561-39-4
CID: 545700
Formula: C8H17NO3
MW: 175.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight175.23
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass175.12084340
Monoisotopic Mass175.12084340
Topological Polar Surface Area49.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity151
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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