AC1MITNN structure

AC1MITNN

1-[4-[2-(diethylamino)ethoxy]phenyl]propan-2-amine;bis(2,4,6-trinitrophenol)

Also Known As: 4-(2-(Diethylamino)ethoxy)-alpha-methylbenzeneethanamine dipicrate|Benzeneethanamine, 4-(2-(diethylamino)ethoxy)-alpha-methyl-, compd. with 2,4,6-trinitrophenol (1:2)|1-[4-(2-diethylaminoethyloxy)phenyl]propan-2-amine; 2,4,6-trinitrophenol|2,4,6-Trinitrophenol--1-{4-[2-(diethylamino)ethoxy]phenyl}propan-2-amine (2/1)

CAS: 126002-24-2
Molecular Formula C27H32N8O15
Molecular Weight 708.1987 g/mol
LogP 4.5305
Topological Polar Surface Area 337.79 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 17
Rotatable Bonds 14
Exact Mass 708.1987
Monoisotopic Mass 708.1987
Heavy Atoms 50
Complexity 1552.2291

Chemical Identifiers

CAS Number 126002-24-2
SMILES CCN(CC)CCOC1=CC=C(C=C1)CC(C)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Product Overview

AC1MITNN (CAS 126002-24-2), with molecular formula C27H32N8O15 and molecular weight 708.1987 g/mol. IUPAC: 1-[4-[2-(diethylamino)ethoxy]phenyl]propan-2-amine;bis(2,4,6-trinitrophenol).

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