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143921-39-5

143921-39-5 | Naphtho[2,1-b]furan-7-carbonitrile, 2-nitro-

CAS No: 143921-39-5 Catalog No: AG001IMJ MDL No:

Product Description

Catalog Number:
AG001IMJ
Chemical Name:
Naphtho[2,1-b]furan-7-carbonitrile, 2-nitro-
CAS Number:
143921-39-5
Molecular Formula:
C13H6N2O3
Molecular Weight:
238.1983
IUPAC Name:
2-nitrobenzo[e][1]benzofuran-7-carbonitrile
InChI:
InChI=1S/C13H6N2O3/c14-7-8-1-3-10-9(5-8)2-4-12-11(10)6-13(18-12)15(16)17/h1-6H
InChI Key:
VSSOQNXUGQEKGW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)ccc1c2cc(o1)[N+](=O)[O-]

Properties

Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.038g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.202g/mol
Monoisotopic Mass:
238.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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