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3-Methoxythiophene-2-carboxamide

CAT: 0127-OR1005191Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
78031-17-1
Purity
98%
Smiles
COC1=C(SC=C1)C(N)=O

Chemical Information

3-Methoxythiophene-2-carboxamide

3-Methoxythiophene-2-carboxamide is an aromatic ether.

CAS Number78031-17-1
PubChem CID593881
IUPAC Name3-methoxythiophene-2-carboxamide
Molecular FormulaC6H7NO2S
Molecular Weight157.19
XLogP0.8
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity140
SMILES
COC1=C(SC=C1)C(=O)N
InChI
InChI=1S/C6H7NO2S/c1-9-4-2-3-10-5(4)6(7)8/h2-3H,1H3,(H2,7,8)
InChIKey
GJMQULWNKQLTIM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxythiophene-2-carboxamide
CAS: 78031-17-1
CID: 593881
Formula: C6H7NO2S
MW: 157.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight157.19
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass157.01974964
Monoisotopic Mass157.01974964
Topological Polar Surface Area80.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity140
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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