N-[2-(2,4-di-tert-butylphenoxy)ethyl]-4-fluoroaniline

N-[2-(2,4-di-tert-butylphenoxy)ethyl]-4-fluoroaniline

CAS: 1040687-56-6

Formula: C22H30FNO

SMILES: CC(C)(C)C1=CC(=C(OCCNC2=CC=C(F)C=C2)C=C1)C(C)(C)C

IUPAC: N-[2-(2,4-di-tert-butylphenoxy)ethyl]-4-fluoroaniline

InChI: InChI=1S/C22H30FNO/c1-21(2,3)16-7-12-20(19(15-16)22(4,5)6)25-14-13-24-18-10-8-17(23)9-11-18/h7-12,15,24H,13-14H2,1-6H3

Composition: C (76.93%), H (8.80%), F (5.53%), N (4.08%), O (4.66%)

Molar Mass: 343.486

Atom Count: 55

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	343.231142753
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	INOZNEOCKAGAJP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	104.35
Topological Polar Surface Area	21.26
Polarizability	39.65
Ring Count	2
Rotatable Bond Count	7

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	1040687-56-6		$212.83$212.83