1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene structure

1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene

1-(2-bromopropyl)naphthalene;1,3,5-trinitrobenzene

Also Known As: 1-(2-bromopropyl)naphthalene; 1,3,5-trinitrobenzene|1-(2-bromopropyl)naphthalene,1,3,5-trinitrobenzene|1,3,5-Trinitrobenzene--1-(2-bromopropyl)naphthalene (1/1)

CAS: 7475-99-2
Molecular Formula C19H16BrN3O6
Molecular Weight 461.02225 g/mol
LogP 5.5769
Topological Polar Surface Area 137.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 461.02225
Monoisotopic Mass 461.02225
Heavy Atoms 29
Complexity 407.0

Chemical Identifiers

CAS Number 7475-99-2
SMILES CC(CC1=CC=CC2=CC=CC=C21)Br.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChIKey SBNROVQAUOJDFD-UHFFFAOYSA-N

Product Overview

1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene (CAS 7475-99-2), with molecular formula C19H16BrN3O6 and molecular weight 461.02225 g/mol. IUPAC: 1-(2-bromopropyl)naphthalene;1,3,5-trinitrobenzene.

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