4-[3,5,7-tris(4-aminophenyl)adamantan-1-yl]aniline

4-[3,5,7-tris(4-aminophenyl)adamantan-1-yl]aniline

CAS: 158562-40-4

Formula: C34H36N4

SMILES: NC1=CC=C(C=C1)C12CC3(CC(C1)(CC(C2)(C3)C1=CC=C(N)C=C1)C1=CC=C(N)C=C1)C1=CC=C(N)C=C1

IUPAC: 4-[3,5,7-tris(4-aminophenyl)adamantan-1-yl]aniline

InChI: InChI=1S/C34H36N4/c35-27-9-1-23(2-10-27)31-17-32(24-3-11-28(36)12-4-24)20-33(18-31,25-5-13-29(37)14-6-25)22-34(19-31,21-32)26-7-15-30(38)16-8-26/h1-16H,17-22,35-38H2

Composition: C (81.56%), H (7.25%), N (11.19%)

Molar Mass: 500.69

Atom Count: 74

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	500.293997175
Formal Charge	0
FSP3	0.29
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
InChIKey	DVSXMGWZXIYBEJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	159.28
Topological Polar Surface Area	104.08
Polarizability	59.67
Ring Count	7
Rotatable Bond Count	4

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