CAS: 61394-50-1
이름: 2-oxo-1,3-dihydroindole-5-carbonitrile
SMILES:
C1C2=C(C=CC(=C2)C#N)NC1=OMolecular Processing
Molecular formula
C9H6N2O
Molecular weight
158.16
Exact mass
158.048
XLogP
1.05
TPSA
52.89
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
43.49
Supplementary Information
InChIKey: NZOSLRYUVHMXTQ-UHFFFAOYSA-N
동의어
2-OXO-2,3-DIHYDRO-1H-INDOLE-5-CARBONITRILERefChem:477700810-851-72-oxoindoline-5-carbonitrile61394-50-15-CYANOOXINDOLE2-oxo-1,3-dihydroindole-5-carbonitrile5-Cyanoindolin-2-oneMFCD021795991H-Indole-5-carbonitrile, 2,3-dihydro-2-oxo-5-cyanooxindol2-oxo-5-indolinecarbonitrileSCHEMBL261156SCHEMBL29771067DTXSID20378394NZOSLRYUVHMXTQ-UHFFFAOYSA-NAKOS000279461AB11378PS-3322AC-22882SY014853DB-014162CS-0054235EN300-31992F093085Z336286144InChI=1/C9H6N2O/c10-5-6-1-2-8-7(3-6)4-9(12)11-8/h1-3H,4H2,(H,11,12
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