Home Nitriles Furan-3-carbonitrile

Furan-3-carbonitrile

CAS No.:
30078-65-0
Catalog Number:
AG003JI9
Molecular Formula:
C5H3NO
Molecular Weight:
93.0834
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Product Description
Catalog Number:
AG003JI9
Chemical Name:
Furan-3-carbonitrile
CAS Number:
30078-65-0
Molecular Formula:
C5H3NO
Molecular Weight:
93.0834
MDL Number:
MFCD00067042
IUPAC Name:
furan-3-carbonitrile
InChI:
InChI=1S/C5H3NO/c6-3-5-1-2-7-4-5/h1-2,4H
InChI Key:
ZQFYJHMUAWCEBH-UHFFFAOYSA-N
SMILES:
N#Cc1cocc1
NSC Number:
349940
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
93.021g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
93.085g/mol
Monoisotopic Mass:
93.021g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Lithium furyl and pyridyl amidinates as building blocks in coordination polymers, ladder and cage structures. Inorganic chemistry 20100201
Properties