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N-[(4-methoxy-3-methylphenyl)methyl]adamantan-2-amine

N-[(4-methoxy-3-methylphenyl)methyl]adamantan-2-amine

Formula: C19H27NO

SMILES: COC1=CC=C(CNC2C3CC4CC(C3)CC2C4)C=C1C

IUPAC: N-[(4-methoxy-3-methylphenyl)methyl]adamantan-2-amine

InChI: InChI=1S/C19H27NO/c1-12-5-13(3-4-18(12)21-2)11-20-19-16-7-14-6-15(9-16)10-17(19)8-14/h3-5,14-17,19-20H,6-11H2,1-2H3

Composition: C (79.95%), H (9.54%), N (4.91%), O (5.61%)

Molar Mass: 285.431

Atom Count: 48

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 285.209264493
Formal Charge 0
FSP3 0.68
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DYYZXMILKXRLFX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.26
Topological Polar Surface Area 21.26
Polarizability 34.23
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H27NO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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