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Home > Nitro Compounds > 261171-52-2
261171-52-2 | Furan, 2-[1-(nitromethyl)ethenyl]-
CAS No: 261171-52-2 Catalog No: AG002RQ3 MDL No:
Product Description
Catalog Number:
AG002RQ3
Chemical Name:
Furan, 2-[1-(nitromethyl)ethenyl]-
CAS Number:
261171-52-2
Molecular Formula:
C7H7NO3
Molecular Weight:
153.1354
IUPAC Name:
2-(3-nitroprop-1-en-2-yl)furan
InChI:
InChI=1S/C7H7NO3/c1-6(5-8(9)10)7-3-2-4-11-7/h2-4H,1,5H2
InChI Key:
XQMKMQQCVRKOSX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CC(=C)c1ccco1
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.137g/mol
Monoisotopic Mass:
153.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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