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4-(azetidin-3-yloxy)benzonitrile

4-(azetidin-3-yloxy)benzonitrile

CAS: 949100-15-6

Formula: C10H10N2O

SMILES: N#CC1=CC=C(OC2CNC2)C=C1

IUPAC: 4-(azetidin-3-yloxy)benzonitrile

InChI: InChI=1S/C10H10N2O/c11-5-8-1-3-9(4-2-8)13-10-6-12-7-10/h1-4,10,12H,6-7H2

Composition: C (68.95%), H (5.79%), N (16.08%), O (9.18%)

Molar Mass: 174.203

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 174.07931295
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NJPYDEOXYPCUHQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.67
Topological Polar Surface Area 45.05
Polarizability 19.15
Ring Count 2
Rotatable Bond Count 2

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