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Home > Nitro Compounds > 317374-44-0
317374-44-0 | ethyl (2E)-3-[5-(4-nitrophenyl)-2-furyl]acrylate
CAS No: 317374-44-0 Catalog No: AG018473 MDL No:
Product Description
Catalog Number:
AG018473
Chemical Name:
ethyl (2E)-3-[5-(4-nitrophenyl)-2-furyl]acrylate
CAS Number:
317374-44-0
Molecular Formula:
C15H13NO5
Molecular Weight:
287.2674
IUPAC Name:
ethyl (E)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-enoate
InChI:
InChI=1S/C15H13NO5/c1-2-20-15(17)10-8-13-7-9-14(21-13)11-3-5-12(6-4-11)16(18)19/h3-10H,2H2,1H3/b10-8+
InChI Key:
BLYZNKPUPAPFOU-CSKARUKUSA-N
SMILES:
CCOC(=O)/C=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
287.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.271g/mol
Monoisotopic Mass:
287.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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