CAS: 107-12-0
名称: propanenitrile
SMILES:
CCC#NMolecular Processing
Molecular formula
C3H5N
Molecular weight
55.08
Exact mass
55.0422
XLogP
0.92
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
4
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
15.9
Supplementary Information
InChIKey: FVSKHRXBFJPNKK-UHFFFAOYSA-N
同義語
PROPIONITRILEPropanenitrileEthyl cyanide107-12-0PropiononitrileCyanoethanePropionic nitrilePropylnitrileEther cyanatusHydrocyanic etherPropannitrilEthylkyanidRCRA waste number P101n-PropanenitrileDTXSID1021879E16N05FX3SNSC-7966DTXCID401879CHEBI:26307RefChem:6168203-464-4NSC 7966EtCNMFCD00001948CH3CHCNC2H5CNEthylkyanid [Czech]Propannitril [Czech]PropionitrilCCRIS 4706
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