N-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine hydrobromide

N-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine hydrobromide

CAS: 1609399-86-1

Formula: C18H22BrNO

SMILES: Br.COC1=CC=CC(CNC2CCCC3=C2C=CC=C3)=C1

IUPAC: N-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine hydrobromide

InChI: InChI=1/C18H21NO.BrH/c1-20-16-9-4-6-14(12-16)13-19-18-11-5-8-15-7-2-3-10-17(15)18;/h2-4,6-7,9-10,12,18-19H,5,8,11,13H2,1H3;1H

Composition: C (62.08%), H (6.37%), Br (22.94%), N (4.02%), O (4.59%)

Molar Mass: 348.284

Atom Count: 43

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	347.088477
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NDTBDLHQCOTCIB-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.56
Topological Polar Surface Area	21.26
Polarizability	32.42
Ring Count	3
Rotatable Bond Count	4

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