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

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

CAS: 355383-24-3

Formula: C17H19BrN2O2

SMILES: Br.[O-][N+](=O)C1=C(CNC2CCCC3=C2C=CC=C3)C=CC=C1

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

InChI: InChI=1/C17H18N2O2.BrH/c20-19(21)17-11-4-2-7-14(17)12-18-16-10-5-8-13-6-1-3-9-15(13)16;/h1-4,6-7,9,11,16,18H,5,8,10,12H2;1H

Composition: C (56.21%), H (5.27%), Br (22.00%), N (7.71%), O (8.81%)

Molar Mass: 363.255

Atom Count: 41

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	362.062991
Formal Charge	0
FSP3	0.29
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KSCRCRXICOVPIH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.42
Topological Polar Surface Area	55.17
Polarizability	31.7
Ring Count	3
Rotatable Bond Count	4

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95%	<4 Days	355383-24-3		$28.75-$1,214.40$28.75$116.15$297.85$1,214.40