pentan-3-yl[(3,4,5-trimethoxyphenyl)methyl]amine hydrobromide

pentan-3-yl[(3,4,5-trimethoxyphenyl)methyl]amine hydrobromide

CAS: 1609404-29-6

Formula: C15H26BrNO3

SMILES: Br.CCC(CC)NCC1=CC(OC)=C(OC)C(OC)=C1

IUPAC: (pentan-3-yl)[(3,4,5-trimethoxyphenyl)methyl]amine hydrobromide

InChI: InChI=1S/C15H25NO3.BrH/c1-6-12(7-2)16-10-11-8-13(17-3)15(19-5)14(9-11)18-4;/h8-9,12,16H,6-7,10H2,1-5H3;1H

Composition: C (51.73%), H (7.52%), Br (22.94%), N (4.02%), O (13.78%)

Molar Mass: 348.281

Atom Count: 46

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	347.109607
Formal Charge	0
FSP3	0.6
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZVDJUHHMRRUKNV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.91
Topological Polar Surface Area	39.72
Polarizability	30.45
Ring Count	1
Rotatable Bond Count	8

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95%	<4 Days	1609404-29-6		$28.75-$1,214.40$28.75$116.15$297.85$1,214.40