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10264-67-2 | 1,2-Benzenedicarbonitrile, 3,6-diethoxy-
CAS No: 10264-67-2 Catalog No: AG00080N MDL No:
Product Description
Catalog Number:
AG00080N
Chemical Name:
1,2-Benzenedicarbonitrile, 3,6-diethoxy-
CAS Number:
10264-67-2
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
IUPAC Name:
3,6-diethoxybenzene-1,2-dicarbonitrile
InChI:
InChI=1S/C12H12N2O2/c1-3-15-11-5-6-12(16-4-2)10(8-14)9(11)7-13/h5-6H,3-4H2,1-2H3
InChI Key:
TWCDHRYFYXXMGU-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1C#N)C#N)OCC
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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