Home Nitriles 1,1-dioxo-2,5-dihydro-1lambda6-thiophene-3-carbonitrile

1,1-dioxo-2,5-dihydro-1lambda6-thiophene-3-carbonitrile

CAS No.:
122131-77-5
Catalog Number:
AG01B9NV
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01B9NV
Chemical Name:
1,1-dioxo-2,5-dihydro-1lambda6-thiophene-3-carbonitrile
CAS Number:
122131-77-5
MDL Number:
MFCD30210724
IUPAC Name:
1,1-dioxo-2,5-dihydrothiophene-3-carbonitrile
InChI:
InChI=1S/C5H5NO2S/c6-3-5-1-2-9(7,8)4-5/h1H,2,4H2
InChI Key:
SNWCSTMLXJTGPT-UHFFFAOYSA-N
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.004g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
143.16g/mol
Monoisotopic Mass:
143.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties