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3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoic acid

3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoic acid

Formula: C13H9NO5

SMILES: OC(=O)C=CC1=CC=C(O1)C1=CC=CC=C1[N+]([O-])=O

IUPAC: 3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoic acid

InChI: InChI=1S/C13H9NO5/c15-13(16)8-6-9-5-7-12(19-9)10-3-1-2-4-11(10)14(17)18/h1-8H,(H,15,16)

Composition: C (60.24%), H (3.50%), N (5.40%), O (30.86%)

Molar Mass: 259.217

Atom Count: 28

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 259.048072394
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey AOSUZFHFKHDFMW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.78
Topological Polar Surface Area 93.58
Polarizability 25.83
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
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Purity LeadTime Formula UnitPrice
98% <10 Days C13H9NO5 Quote Only