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710-25-8 | 2-Propenamide,3-(5-nitro-2-furanyl)-
CAS No: 710-25-8 Catalog No: AG005F4L MDL No:
Product Description
Catalog Number:
AG005F4L
Chemical Name:
2-Propenamide,3-(5-nitro-2-furanyl)-
CAS Number:
710-25-8
Molecular Formula:
C7H6N2O4
Molecular Weight:
182.1335
IUPAC Name:
(E)-3-(5-nitrofuran-2-yl)prop-2-enamide
InChI:
InChI=1S/C7H6N2O4/c8-6(10)3-1-5-2-4-7(13-5)9(11)12/h1-4H,(H2,8,10)/b3-1+
InChI Key:
IZFMIIGMIPRYKL-HNQUOIGGSA-N
SMILES:
NC(=O)C(=C)c1ccc(o1)[N+](=O)[O-]
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
182.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.135g/mol
Monoisotopic Mass:
182.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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