CAS: 34916-10-4
الاسم: 4-oxocyclohexane-1-carbonitrile
SMILES:
C1CC(=O)CCC1C#NMolecular Processing
Molecular formula
C7H9NO
Molecular weight
123.16
Exact mass
123.0684
XLogP
1.27
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
32.58
Supplementary Information
InChIKey: QIWQJGMBIABGRX-UHFFFAOYSA-N
مرادفات
4-oxocyclohexane-1-carbonitrileRefChem:526205838-680-34-oxocyclohexanecarbonitrile34916-10-44-Oxo-cyclohexanecarbonitrile4-cyanocyclohexanoneMFCD11847831Cyclohexanecarbonitrile, 4-oxo-4-cyano-cyclohexanoneSCHEMBL628776DTXSID30481722QIWQJGMBIABGRX-UHFFFAOYSA-NCS-D0281AKOS005145509SB14026DS-14152SY008433EN300-130790F079621
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