4-(2-bromo-4-methylphenoxymethyl)piperidine

4-(2-bromo-4-methylphenoxymethyl)piperidine

CAS: 946725-26-4

Formula: C13H18BrNO

SMILES: CC1=CC(Br)=C(OCC2CCNCC2)C=C1

IUPAC: 4-[(2-bromo-4-methylphenoxy)methyl]piperidine

InChI: InChI=1S/C13H18BrNO/c1-10-2-3-13(12(14)8-10)16-9-11-4-6-15-7-5-11/h2-3,8,11,15H,4-7,9H2,1H3

Composition: C (54.94%), H (6.38%), Br (28.12%), N (4.93%), O (5.63%)

Molar Mass: 284.197

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	283.057177
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	AYSYGLFRHMBOLQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.16
Topological Polar Surface Area	21.26
Polarizability	27.34
Ring Count	2
Rotatable Bond Count	3

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	946725-26-4		$219.25$219.25