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N-[4-(adamantan-1-yl)phenyl]acetamide

N-[4-(adamantan-1-yl)phenyl]acetamide

CAS: 1459-50-3

Formula: C18H23NO

SMILES: CC(=O)NC1=CC=C(C=C1)C12CC3CC(CC(C3)C1)C2

IUPAC: N-[4-(adamantan-1-yl)phenyl]acetamide

InChI: InChI=1S/C18H23NO/c1-12(20)19-17-4-2-16(3-5-17)18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3,(H,19,20)

Composition: C (80.26%), H (8.61%), N (5.20%), O (5.94%)

Molar Mass: 269.388

Atom Count: 43

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 269.177964365
Formal Charge 0
FSP3 0.61
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ZVJQMQNYDNEXKB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.63
Topological Polar Surface Area 29.1
Polarizability 31.37
Ring Count 4
Rotatable Bond Count 2

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97% <5 Days 1459-50-3 $44.14-$142.49$44.14$66.83$142.49
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