C1COCCC1(C#N)C#N
CAS: 111511-90-1
الاسم: oxane-4,4-dicarbonitrile
SMILES: C1COCCC1(C#N)C#N

Molecular Processing

Molecular formula
C7H8N2O
Molecular weight
136.15
Exact mass
136.0637
XLogP
0.83
TPSA
56.81
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
10
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
33.71

Supplementary Information

InChIKey: BZWZQQPETNQTFG-UHFFFAOYSA-N
مرادفات
111511-90-1Dihydro-2H-pyran-4,4(3H)-dicarbonitriletetrahydro-4H-pyran-4,4-dicarbonitrileOXANE-4,4-DICARBONITRILETetrahydropyran-4,4-dicarbonitrileMFCD193131754H-Pyran-4,4-dicarbonitrile, tetrahydro-SCHEMBL1192072DTXSID40561428BZWZQQPETNQTFG-UHFFFAOYSA-NTetrahydro-pyran-4,4-dicarbonitrileAKOS022341730AS-43670DB-299279CS-0007928
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