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2-Furamide-3,4,5-d3

CAT: 0926-UYB79931-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-UYB79931-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1219799-31-1
Smiles
C1=COC (=C1) C (=O) N
Molecular Formula
C5H5NO2
Molecular Weight
114.12 g/mol
Controlled
No

Chemical Information

2-Furamide-3,4,5-D3
CAS Number1219799-31-1
PubChem CID162343622
IUPAC Name3,4,5-trideuteriofuran-2-carboxamide
Molecular FormulaC5H5NO2
Molecular Weight114.12
XLogP-0.1
Topological Polar Surface Area56.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count8
Formal Charge0
Complexity103
SMILES
[2H]C1=C(OC(=C1[2H])C(=O)N)[2H]
InChI
InChI=1S/C5H5NO2/c6-5(7)4-2-1-3-8-4/h1-3H,(H2,6,7)/i1D,2D,3D
InChIKey
TVFIYRKPCACCNL-CBYSEHNBSA-N
Chemical Structure
2D Structure
2D structure of 2-Furamide-3,4,5-D3
CAS: 1219799-31-1
CID: 162343622
Formula: C5H5NO2
MW: 114.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight114.12
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass114.050858640
Monoisotopic Mass114.050858640
Topological Polar Surface Area56.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity103
Isotope Atom Count3
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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Alternative Products

CatalogName
B4142142-Furamide-3,4,5-d3
PC300940-015- (4-Chlorophenyl) -2- (trifluoromethyl) -3-furamide
sc-2908115-bromo-2-furamide
sc-329730N- (4-Acetylphenyl) -5-bromo-2-furamide
sc-329733N- (4-Acetylphenyl) -5-methyl-2-furamide
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sc-329240N- (3-Acetylphenyl) -5-methyl-2-furamide
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sc-329707N- (4-Acetylphenyl) -2-methyl-3-furamide
sc-329414N- (3-Amino-4-chlorophenyl) -2-furamide

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