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

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

Formula: C23H24BrNO

SMILES: BrC1=CC=C(C=C1)C(=O)NC1=CC=C(C=C1)C12CC3CC(CC(C3)C1)C2

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

InChI: InChI=1S/C23H24BrNO/c24-20-5-1-18(2-6-20)22(26)25-21-7-3-19(4-8-21)23-12-15-9-16(13-23)11-17(10-15)14-23/h1-8,15-17H,9-14H2,(H,25,26)

Composition: C (67.32%), H (5.90%), Br (19.47%), N (3.41%), O (3.90%)

Molar Mass: 410.355

Atom Count: 50

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 409.104127
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PYYDRGYAJMQWJQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 109.92
Topological Polar Surface Area 29.1
Polarizability 41.75
Ring Count 5
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H24BrNO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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