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Home > Nitro Compounds > 19275-29-7
19275-29-7 | Furan, 2-ethynyl-5-nitro-
CAS No: 19275-29-7 Catalog No: AG002GAN MDL No:
Product Description
Catalog Number:
AG002GAN
Chemical Name:
Furan, 2-ethynyl-5-nitro-
CAS Number:
19275-29-7
Molecular Formula:
C6H3NO3
Molecular Weight:
137.0929
IUPAC Name:
2-ethynyl-5-nitrofuran
InChI:
InChI=1S/C6H3NO3/c1-2-5-3-4-6(10-5)7(8)9/h1,3-4H
InChI Key:
GJXYAJOKVJCOCT-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(o1)[N+](=O)[O-]
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.011g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.094g/mol
Monoisotopic Mass:
137.011g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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