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13134-06-0 | 3-Furancarboxamide, tetrahydro-4,5,5-trimethyl-2-oxo-
CAS No: 13134-06-0 Catalog No: AG000VZH MDL No:MFCD20695395
Product Description
Catalog Number:
AG000VZH
Chemical Name:
3-Furancarboxamide, tetrahydro-4,5,5-trimethyl-2-oxo-
CAS Number:
13134-06-0
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
MDL Number:
MFCD20695395
IUPAC Name:
4,5,5-trimethyl-2-oxooxolane-3-carboxamide
InChI:
InChI=1S/C8H13NO3/c1-4-5(6(9)10)7(11)12-8(4,2)3/h4-5H,1-3H3,(H2,9,10)
InChI Key:
FTTNAEMJRWNKHM-UHFFFAOYSA-N
SMILES:
NC(=O)C1C(=O)OC(C1C)(C)C
NSC Number:
108988
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.196g/mol
Monoisotopic Mass:
171.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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