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

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

CAS: 353779-33-6

Formula: C17H19BrN2O2

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

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

InChI: InChI=1/C17H18N2O2.BrH/c20-19(21)15-8-3-5-13(11-15)12-18-17-10-4-7-14-6-1-2-9-16(14)17;/h1-3,5-6,8-9,11,17-18H,4,7,10,12H2;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	FEKATPMRLMTMEM-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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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	353779-33-6		$28.75-$1,216.70$28.75$116.15$297.85$1,216.70